USER MOD reduce.3.24.130724 H: found=0, std=0, add=1106, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1106 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 108 SER OG : rot 180:sc= 0.986 USER MOD Set 1.2: A 124 THR OG1 : rot -109:sc= 1.31 USER MOD Set 2.1: A 92 LYS NZ :NH3+ -114:sc= 0.238 (180deg=-1.2) USER MOD Set 2.2: A 110 THR OG1 : rot 43:sc= 1.21! USER MOD Set 3.1: A 95 CYS SG : rot -167:sc= -1.96 USER MOD Set 3.2: A 97 GLN : amide:sc= -1.37 K(o=-3.3,f=-3.9) USER MOD Set 4.1: A 56 THR OG1 : rot 180:sc= 0 USER MOD Set 4.2: A 57 THR OG1 : rot 180:sc= -0.807 USER MOD Set 5.1: A 2 ASN : amide:sc= 0 X(o=-2.2,f=-2.7) USER MOD Set 5.2: A 91 ASN : amide:sc= -2.24 K(o=-2.2,f=-10!) USER MOD Single : A 4 SER OG : rot -8:sc= 0.858 USER MOD Single : A 6 ASN : amide:sc= -1.47 K(o=-1.5,f=-3.6!) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 SER OG : rot -40:sc= -1.12 USER MOD Single : A 14 ASN : amide:sc= -2.54 K(o=-2.5,f=-3.1!) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 ASN : amide:sc= -0.341 K(o=-0.34,f=-2.4!) USER MOD Single : A 27 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 SER OG : rot 180:sc= 0.00464 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 GLN : amide:sc= -3.4 K(o=-3.4,f=-2.7!) USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 TYR OH : rot 4:sc= -1.13! USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 THR OG1 : rot 180:sc= -0.0531 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 60 THR OG1 : rot -130:sc= -1.3 USER MOD Single : A 61 THR OG1 : rot 180:sc= -0.389 USER MOD Single : A 64 ASN : amide:sc= -1.54! K(o=-1.5!,f=-0.03) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 GLN : amide:sc= 0 K(o=0,f=-0.53) USER MOD Single : A 75 THR OG1 : rot -118:sc= 1.08 USER MOD Single : A 81 CYS SG : rot 180:sc= -2.12 USER MOD Single : A 82 LYS NZ :NH3+ -143:sc= -0.0363 (180deg=-1.34!) USER MOD Single : A 83 SER OG : rot 121:sc= 0.809 USER MOD Single : A 86 LYS NZ :NH3+ -160:sc= -0.685 (180deg=-1.11) USER MOD Single : A 89 SER OG : rot 180:sc= -0.157 USER MOD Single : A 93 MET CE :methyl 177:sc= -4.86! (180deg=-4.88!) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 THR OG1 : rot 180:sc= -0.0183 USER MOD Single : A 114 THR OG1 : rot 105:sc= 0.639 USER MOD Single : A 115 ASN : amide:sc= -0.0249 K(o=-0.025,f=-1.5!) USER MOD Single : A 122 THR OG1 : rot 180:sc= -4.05! USER MOD Single : A 123 MET CE :methyl -163:sc= -0.0404 (180deg=-0.594) USER MOD Single : A 130 CYS SG : rot 180:sc= 0 USER MOD Single : A 131 THR OG1 : rot 180:sc= -0.342 USER MOD Single : A 134 TYR OH : rot 180:sc= -2.54 USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 -15.360 -0.118 10.693 1.00 0.00 N ATOM 2 CA PRO A 1 -13.944 -0.086 10.194 1.00 0.00 C ATOM 3 C PRO A 1 -13.650 1.220 9.436 1.00 0.00 C ATOM 4 O PRO A 1 -12.519 1.655 9.393 1.00 0.00 O ATOM 5 CB PRO A 1 -13.746 -1.272 9.245 1.00 0.00 C ATOM 6 CG PRO A 1 -15.080 -2.004 9.159 1.00 0.00 C ATOM 7 CD PRO A 1 -16.100 -1.182 9.948 1.00 0.00 C ATOM 0 H2 PRO A 1 -15.806 0.789 10.553 1.00 0.00 H new ATOM 0 H3 PRO A 1 -15.379 -0.308 11.695 1.00 0.00 H new ATOM 0 HA PRO A 1 -13.265 -0.144 11.045 1.00 0.00 H new ATOM 0 HB2 PRO A 1 -13.431 -0.929 8.260 1.00 0.00 H new ATOM 0 HB3 PRO A 1 -12.965 -1.936 9.616 1.00 0.00 H new ATOM 0 HG2 PRO A 1 -15.393 -2.111 8.121 1.00 0.00 H new ATOM 0 HG3 PRO A 1 -14.994 -3.009 9.572 1.00 0.00 H new ATOM 0 HD2 PRO A 1 -16.833 -0.736 9.275 1.00 0.00 H new ATOM 0 HD3 PRO A 1 -16.650 -1.820 10.640 1.00 0.00 H new ATOM 17 N ASN A 2 -14.644 1.826 8.809 1.00 0.00 N ATOM 18 CA ASN A 2 -14.410 3.084 8.026 1.00 0.00 C ATOM 19 C ASN A 2 -13.678 2.713 6.731 1.00 0.00 C ATOM 20 O ASN A 2 -13.981 1.693 6.152 1.00 0.00 O ATOM 21 CB ASN A 2 -13.660 4.125 8.882 1.00 0.00 C ATOM 22 CG ASN A 2 -14.486 4.443 10.129 1.00 0.00 C ATOM 23 OD1 ASN A 2 -14.345 3.794 11.147 1.00 0.00 O ATOM 24 ND2 ASN A 2 -15.349 5.421 10.093 1.00 0.00 N ATOM 0 H ASN A 2 -15.610 1.497 8.810 1.00 0.00 H new ATOM 0 HA ASN A 2 -15.353 3.558 7.755 1.00 0.00 H new ATOM 0 HB2 ASN A 2 -12.681 3.740 9.168 1.00 0.00 H new ATOM 0 HB3 ASN A 2 -13.489 5.033 8.304 1.00 0.00 H new ATOM 0 HD21 ASN A 2 -15.905 5.641 10.919 1.00 0.00 H new ATOM 0 HD22 ASN A 2 -15.467 5.966 9.239 1.00 0.00 H new ATOM 31 N PHE A 3 -12.754 3.520 6.272 1.00 0.00 N ATOM 32 CA PHE A 3 -11.997 3.251 4.990 1.00 0.00 C ATOM 33 C PHE A 3 -12.825 3.678 3.763 1.00 0.00 C ATOM 34 O PHE A 3 -12.315 4.321 2.865 1.00 0.00 O ATOM 35 CB PHE A 3 -11.616 1.771 4.810 1.00 0.00 C ATOM 36 CG PHE A 3 -10.707 1.291 5.917 1.00 0.00 C ATOM 37 CD1 PHE A 3 -11.242 0.827 7.126 1.00 0.00 C ATOM 38 CD2 PHE A 3 -9.323 1.261 5.713 1.00 0.00 C ATOM 39 CE1 PHE A 3 -10.411 0.332 8.113 1.00 0.00 C ATOM 40 CE2 PHE A 3 -8.484 0.773 6.717 1.00 0.00 C ATOM 41 CZ PHE A 3 -9.035 0.299 7.923 1.00 0.00 C ATOM 0 H PHE A 3 -12.479 4.383 6.741 1.00 0.00 H new ATOM 0 HA PHE A 3 -11.082 3.838 5.067 1.00 0.00 H new ATOM 0 HB2 PHE A 3 -12.520 1.162 4.791 1.00 0.00 H new ATOM 0 HB3 PHE A 3 -11.121 1.637 3.848 1.00 0.00 H new ATOM 0 HD1 PHE A 3 -12.309 0.856 7.287 1.00 0.00 H new ATOM 0 HD2 PHE A 3 -8.905 1.614 4.782 1.00 0.00 H new ATOM 0 HE1 PHE A 3 -10.834 -0.032 9.038 1.00 0.00 H new ATOM 0 HE2 PHE A 3 -7.414 0.759 6.569 1.00 0.00 H new ATOM 0 HZ PHE A 3 -8.390 -0.089 8.698 1.00 0.00 H new ATOM 51 N SER A 4 -14.088 3.309 3.697 1.00 0.00 N ATOM 52 CA SER A 4 -14.939 3.667 2.517 1.00 0.00 C ATOM 53 C SER A 4 -14.838 5.168 2.208 1.00 0.00 C ATOM 54 O SER A 4 -15.133 5.999 3.046 1.00 0.00 O ATOM 55 CB SER A 4 -16.397 3.311 2.827 1.00 0.00 C ATOM 56 OG SER A 4 -16.994 4.347 3.601 1.00 0.00 O ATOM 0 H SER A 4 -14.567 2.770 4.419 1.00 0.00 H new ATOM 0 HA SER A 4 -14.589 3.109 1.648 1.00 0.00 H new ATOM 0 HB2 SER A 4 -16.952 3.172 1.899 1.00 0.00 H new ATOM 0 HB3 SER A 4 -16.443 2.367 3.370 1.00 0.00 H new ATOM 0 HG SER A 4 -16.306 4.988 3.876 1.00 0.00 H new ATOM 62 N GLY A 5 -14.432 5.517 1.013 1.00 0.00 N ATOM 63 CA GLY A 5 -14.322 6.959 0.652 1.00 0.00 C ATOM 64 C GLY A 5 -13.099 7.181 -0.222 1.00 0.00 C ATOM 65 O GLY A 5 -12.120 6.462 -0.140 1.00 0.00 O ATOM 0 H GLY A 5 -14.173 4.864 0.274 1.00 0.00 H new ATOM 0 HA2 GLY A 5 -15.220 7.280 0.124 1.00 0.00 H new ATOM 0 HA3 GLY A 5 -14.249 7.565 1.555 1.00 0.00 H new ATOM 69 N ASN A 6 -13.142 8.199 -1.027 1.00 0.00 N ATOM 70 CA ASN A 6 -11.978 8.524 -1.888 1.00 0.00 C ATOM 71 C ASN A 6 -10.952 9.170 -0.983 1.00 0.00 C ATOM 72 O ASN A 6 -11.310 9.723 0.042 1.00 0.00 O ATOM 73 CB ASN A 6 -12.391 9.493 -2.999 1.00 0.00 C ATOM 74 CG ASN A 6 -11.194 9.759 -3.914 1.00 0.00 C ATOM 75 OD1 ASN A 6 -10.238 10.392 -3.514 1.00 0.00 O ATOM 76 ND2 ASN A 6 -11.206 9.298 -5.135 1.00 0.00 N ATOM 0 H ASN A 6 -13.941 8.826 -1.127 1.00 0.00 H new ATOM 0 HA ASN A 6 -11.579 7.631 -2.369 1.00 0.00 H new ATOM 0 HB2 ASN A 6 -13.216 9.073 -3.574 1.00 0.00 H new ATOM 0 HB3 ASN A 6 -12.747 10.428 -2.567 1.00 0.00 H new ATOM 0 HD21 ASN A 6 -10.413 9.469 -5.753 1.00 0.00 H new ATOM 0 HD22 ASN A 6 -12.009 8.766 -5.471 1.00 0.00 H new ATOM 83 N TRP A 7 -9.687 9.075 -1.299 1.00 0.00 N ATOM 84 CA TRP A 7 -8.679 9.665 -0.370 1.00 0.00 C ATOM 85 C TRP A 7 -7.696 10.580 -1.075 1.00 0.00 C ATOM 86 O TRP A 7 -7.079 10.224 -2.061 1.00 0.00 O ATOM 87 CB TRP A 7 -7.920 8.537 0.292 1.00 0.00 C ATOM 88 CG TRP A 7 -8.874 7.686 1.040 1.00 0.00 C ATOM 89 CD1 TRP A 7 -9.422 6.538 0.596 1.00 0.00 C ATOM 90 CD2 TRP A 7 -9.424 7.927 2.351 1.00 0.00 C ATOM 91 NE1 TRP A 7 -10.237 6.027 1.587 1.00 0.00 N ATOM 92 CE2 TRP A 7 -10.277 6.859 2.692 1.00 0.00 C ATOM 93 CE3 TRP A 7 -9.245 8.962 3.270 1.00 0.00 C ATOM 94 CZ2 TRP A 7 -10.936 6.821 3.921 1.00 0.00 C ATOM 95 CZ3 TRP A 7 -9.908 8.946 4.496 1.00 0.00 C ATOM 96 CH2 TRP A 7 -10.755 7.875 4.829 1.00 0.00 C ATOM 0 H TRP A 7 -9.315 8.627 -2.137 1.00 0.00 H new ATOM 0 HA TRP A 7 -9.214 10.271 0.362 1.00 0.00 H new ATOM 0 HB2 TRP A 7 -7.396 7.945 -0.458 1.00 0.00 H new ATOM 0 HB3 TRP A 7 -7.164 8.938 0.967 1.00 0.00 H new ATOM 0 HD1 TRP A 7 -9.252 6.092 -0.373 1.00 0.00 H new ATOM 0 HE1 TRP A 7 -10.746 5.146 1.514 1.00 0.00 H new ATOM 0 HE3 TRP A 7 -8.586 9.783 3.029 1.00 0.00 H new ATOM 0 HZ2 TRP A 7 -11.578 5.989 4.171 1.00 0.00 H new ATOM 0 HZ3 TRP A 7 -9.770 9.760 5.193 1.00 0.00 H new ATOM 0 HH2 TRP A 7 -11.265 7.863 5.781 1.00 0.00 H new ATOM 107 N LYS A 8 -7.533 11.759 -0.539 1.00 0.00 N ATOM 108 CA LYS A 8 -6.570 12.725 -1.122 1.00 0.00 C ATOM 109 C LYS A 8 -5.219 12.486 -0.449 1.00 0.00 C ATOM 110 O LYS A 8 -5.159 11.957 0.648 1.00 0.00 O ATOM 111 CB LYS A 8 -7.012 14.180 -0.860 1.00 0.00 C ATOM 112 CG LYS A 8 -8.550 14.306 -0.811 1.00 0.00 C ATOM 113 CD LYS A 8 -8.993 14.692 0.607 1.00 0.00 C ATOM 114 CE LYS A 8 -9.360 16.177 0.649 1.00 0.00 C ATOM 115 NZ LYS A 8 -8.967 16.749 1.967 1.00 0.00 N ATOM 0 H LYS A 8 -8.032 12.093 0.285 1.00 0.00 H new ATOM 0 HA LYS A 8 -6.515 12.579 -2.201 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -6.588 14.526 0.083 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -6.618 14.827 -1.643 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -8.886 15.058 -1.525 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -9.011 13.362 -1.102 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -9.849 14.088 0.908 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -8.192 14.486 1.317 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -8.855 16.710 -0.156 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -10.431 16.302 0.491 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -9.216 17.758 1.996 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -9.469 16.247 2.727 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -7.941 16.642 2.100 1.00 0.00 H new ATOM 129 N ILE A 9 -4.140 12.859 -1.088 1.00 0.00 N ATOM 130 CA ILE A 9 -2.797 12.639 -0.476 1.00 0.00 C ATOM 131 C ILE A 9 -2.550 13.698 0.610 1.00 0.00 C ATOM 132 O ILE A 9 -2.914 14.849 0.471 1.00 0.00 O ATOM 133 CB ILE A 9 -1.720 12.665 -1.592 1.00 0.00 C ATOM 134 CG1 ILE A 9 -0.585 11.690 -1.236 1.00 0.00 C ATOM 135 CG2 ILE A 9 -1.149 14.076 -1.815 1.00 0.00 C ATOM 136 CD1 ILE A 9 0.151 12.151 0.028 1.00 0.00 C ATOM 0 H ILE A 9 -4.132 13.305 -2.005 1.00 0.00 H new ATOM 0 HA ILE A 9 -2.746 11.663 0.008 1.00 0.00 H new ATOM 0 HB ILE A 9 -2.199 12.358 -2.522 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -0.993 10.691 -1.081 1.00 0.00 H new ATOM 0 HG13 ILE A 9 0.117 11.623 -2.067 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -0.399 14.044 -2.605 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -1.953 14.752 -2.105 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -0.690 14.433 -0.893 1.00 0.00 H new ATOM 0 HD11 ILE A 9 0.950 11.447 0.261 1.00 0.00 H new ATOM 0 HD12 ILE A 9 0.577 13.140 -0.139 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -0.550 12.194 0.862 1.00 0.00 H new ATOM 148 N ILE A 10 -1.933 13.295 1.680 1.00 0.00 N ATOM 149 CA ILE A 10 -1.644 14.217 2.801 1.00 0.00 C ATOM 150 C ILE A 10 -0.397 13.687 3.522 1.00 0.00 C ATOM 151 O ILE A 10 -0.377 12.579 4.017 1.00 0.00 O ATOM 152 CB ILE A 10 -2.874 14.254 3.733 1.00 0.00 C ATOM 153 CG1 ILE A 10 -3.974 15.104 3.079 1.00 0.00 C ATOM 154 CG2 ILE A 10 -2.529 14.858 5.102 1.00 0.00 C ATOM 155 CD1 ILE A 10 -4.955 14.203 2.320 1.00 0.00 C ATOM 0 H ILE A 10 -1.609 12.339 1.826 1.00 0.00 H new ATOM 0 HA ILE A 10 -1.451 15.234 2.461 1.00 0.00 H new ATOM 0 HB ILE A 10 -3.213 13.230 3.886 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -4.506 15.673 3.841 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -3.528 15.826 2.395 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -3.420 14.867 5.730 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -1.754 14.258 5.579 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -2.168 15.878 4.969 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -5.731 14.816 1.860 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -4.420 13.654 1.545 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -5.413 13.498 3.014 1.00 0.00 H new ATOM 167 N ARG A 11 0.643 14.470 3.548 1.00 0.00 N ATOM 168 CA ARG A 11 1.920 14.050 4.206 1.00 0.00 C ATOM 169 C ARG A 11 2.503 12.841 3.471 1.00 0.00 C ATOM 170 O ARG A 11 1.904 11.784 3.420 1.00 0.00 O ATOM 171 CB ARG A 11 1.671 13.697 5.679 1.00 0.00 C ATOM 172 CG ARG A 11 1.792 14.962 6.531 1.00 0.00 C ATOM 173 CD ARG A 11 0.661 15.927 6.171 1.00 0.00 C ATOM 174 NE ARG A 11 0.465 16.901 7.283 1.00 0.00 N ATOM 175 CZ ARG A 11 -0.002 18.093 7.032 1.00 0.00 C ATOM 176 NH1 ARG A 11 -1.179 18.231 6.485 1.00 0.00 N ATOM 177 NH2 ARG A 11 0.708 19.148 7.327 1.00 0.00 N ATOM 0 H ARG A 11 0.667 15.402 3.134 1.00 0.00 H new ATOM 0 HA ARG A 11 2.629 14.877 4.162 1.00 0.00 H new ATOM 0 HB2 ARG A 11 0.680 13.259 5.797 1.00 0.00 H new ATOM 0 HB3 ARG A 11 2.391 12.950 6.012 1.00 0.00 H new ATOM 0 HG2 ARG A 11 1.744 14.707 7.590 1.00 0.00 H new ATOM 0 HG3 ARG A 11 2.758 15.437 6.361 1.00 0.00 H new ATOM 0 HD2 ARG A 11 0.900 16.456 5.248 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -0.261 15.373 5.992 1.00 0.00 H new ATOM 0 HE ARG A 11 0.696 16.635 8.240 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -1.734 17.407 6.254 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -1.544 19.163 6.289 1.00 0.00 H new ATOM 0 HH21 ARG A 11 1.628 19.040 7.754 1.00 0.00 H new ATOM 0 HH22 ARG A 11 0.343 20.080 7.131 1.00 0.00 H new ATOM 191 N SER A 12 3.668 13.000 2.893 1.00 0.00 N ATOM 192 CA SER A 12 4.303 11.874 2.147 1.00 0.00 C ATOM 193 C SER A 12 5.827 12.037 2.169 1.00 0.00 C ATOM 194 O SER A 12 6.350 13.105 1.911 1.00 0.00 O ATOM 195 CB SER A 12 3.805 11.888 0.698 1.00 0.00 C ATOM 196 OG SER A 12 3.397 10.578 0.327 1.00 0.00 O ATOM 0 H SER A 12 4.207 13.866 2.907 1.00 0.00 H new ATOM 0 HA SER A 12 4.038 10.927 2.617 1.00 0.00 H new ATOM 0 HB2 SER A 12 2.972 12.583 0.595 1.00 0.00 H new ATOM 0 HB3 SER A 12 4.595 12.237 0.033 1.00 0.00 H new ATOM 0 HG SER A 12 4.027 9.923 0.694 1.00 0.00 H new ATOM 202 N GLU A 13 6.537 10.981 2.469 1.00 0.00 N ATOM 203 CA GLU A 13 8.028 11.048 2.508 1.00 0.00 C ATOM 204 C GLU A 13 8.572 9.656 2.829 1.00 0.00 C ATOM 205 O GLU A 13 8.698 9.286 3.981 1.00 0.00 O ATOM 206 CB GLU A 13 8.471 12.033 3.594 1.00 0.00 C ATOM 207 CG GLU A 13 9.942 12.397 3.385 1.00 0.00 C ATOM 208 CD GLU A 13 10.535 12.903 4.702 1.00 0.00 C ATOM 209 OE1 GLU A 13 10.853 12.077 5.542 1.00 0.00 O ATOM 210 OE2 GLU A 13 10.662 14.108 4.847 1.00 0.00 O ATOM 0 H GLU A 13 6.144 10.066 2.691 1.00 0.00 H new ATOM 0 HA GLU A 13 8.410 11.385 1.544 1.00 0.00 H new ATOM 0 HB2 GLU A 13 7.855 12.931 3.558 1.00 0.00 H new ATOM 0 HB3 GLU A 13 8.332 11.590 4.580 1.00 0.00 H new ATOM 0 HG2 GLU A 13 10.497 11.527 3.035 1.00 0.00 H new ATOM 0 HG3 GLU A 13 10.032 13.163 2.615 1.00 0.00 H new ATOM 217 N ASN A 14 8.877 8.878 1.820 1.00 0.00 N ATOM 218 CA ASN A 14 9.392 7.495 2.074 1.00 0.00 C ATOM 219 C ASN A 14 10.076 6.891 0.832 1.00 0.00 C ATOM 220 O ASN A 14 10.905 6.020 0.969 1.00 0.00 O ATOM 221 CB ASN A 14 8.226 6.597 2.477 1.00 0.00 C ATOM 222 CG ASN A 14 8.051 6.629 3.997 1.00 0.00 C ATOM 223 OD1 ASN A 14 7.209 7.340 4.508 1.00 0.00 O ATOM 224 ND2 ASN A 14 8.816 5.883 4.745 1.00 0.00 N ATOM 0 H ASN A 14 8.793 9.138 0.837 1.00 0.00 H new ATOM 0 HA ASN A 14 10.135 7.559 2.869 1.00 0.00 H new ATOM 0 HB2 ASN A 14 7.311 6.932 1.989 1.00 0.00 H new ATOM 0 HB3 ASN A 14 8.409 5.575 2.144 1.00 0.00 H new ATOM 0 HD21 ASN A 14 8.707 5.897 5.759 1.00 0.00 H new ATOM 0 HD22 ASN A 14 9.523 5.286 4.316 1.00 0.00 H new ATOM 231 N PHE A 15 9.718 7.312 -0.371 1.00 0.00 N ATOM 232 CA PHE A 15 10.331 6.723 -1.621 1.00 0.00 C ATOM 233 C PHE A 15 11.852 6.554 -1.493 1.00 0.00 C ATOM 234 O PHE A 15 12.381 5.501 -1.789 1.00 0.00 O ATOM 235 CB PHE A 15 10.035 7.621 -2.830 1.00 0.00 C ATOM 236 CG PHE A 15 10.187 6.818 -4.109 1.00 0.00 C ATOM 237 CD1 PHE A 15 11.447 6.338 -4.502 1.00 0.00 C ATOM 238 CD2 PHE A 15 9.064 6.547 -4.902 1.00 0.00 C ATOM 239 CE1 PHE A 15 11.577 5.593 -5.681 1.00 0.00 C ATOM 240 CE2 PHE A 15 9.198 5.799 -6.079 1.00 0.00 C ATOM 241 CZ PHE A 15 10.455 5.322 -6.467 1.00 0.00 C ATOM 0 H PHE A 15 9.025 8.041 -0.540 1.00 0.00 H new ATOM 0 HA PHE A 15 9.885 5.738 -1.761 1.00 0.00 H new ATOM 0 HB2 PHE A 15 9.024 8.023 -2.759 1.00 0.00 H new ATOM 0 HB3 PHE A 15 10.716 8.472 -2.840 1.00 0.00 H new ATOM 0 HD1 PHE A 15 12.316 6.543 -3.895 1.00 0.00 H new ATOM 0 HD2 PHE A 15 8.093 6.916 -4.605 1.00 0.00 H new ATOM 0 HE1 PHE A 15 12.547 5.227 -5.983 1.00 0.00 H new ATOM 0 HE2 PHE A 15 8.330 5.590 -6.687 1.00 0.00 H new ATOM 0 HZ PHE A 15 10.557 4.745 -7.374 1.00 0.00 H new ATOM 251 N GLU A 16 12.555 7.563 -1.061 1.00 0.00 N ATOM 252 CA GLU A 16 14.035 7.424 -0.928 1.00 0.00 C ATOM 253 C GLU A 16 14.332 6.484 0.230 1.00 0.00 C ATOM 254 O GLU A 16 15.245 5.681 0.170 1.00 0.00 O ATOM 255 CB GLU A 16 14.673 8.792 -0.676 1.00 0.00 C ATOM 256 CG GLU A 16 16.197 8.656 -0.684 1.00 0.00 C ATOM 257 CD GLU A 16 16.803 9.660 0.298 1.00 0.00 C ATOM 258 OE1 GLU A 16 16.504 9.562 1.476 1.00 0.00 O ATOM 259 OE2 GLU A 16 17.556 10.512 -0.146 1.00 0.00 O ATOM 0 H GLU A 16 12.175 8.471 -0.796 1.00 0.00 H new ATOM 0 HA GLU A 16 14.453 7.018 -1.849 1.00 0.00 H new ATOM 0 HB2 GLU A 16 14.357 9.499 -1.443 1.00 0.00 H new ATOM 0 HB3 GLU A 16 14.338 9.190 0.282 1.00 0.00 H new ATOM 0 HG2 GLU A 16 16.484 7.642 -0.407 1.00 0.00 H new ATOM 0 HG3 GLU A 16 16.584 8.834 -1.688 1.00 0.00 H new ATOM 266 N GLU A 17 13.538 6.546 1.266 1.00 0.00 N ATOM 267 CA GLU A 17 13.733 5.621 2.419 1.00 0.00 C ATOM 268 C GLU A 17 13.605 4.172 1.914 1.00 0.00 C ATOM 269 O GLU A 17 14.086 3.246 2.535 1.00 0.00 O ATOM 270 CB GLU A 17 12.648 5.901 3.472 1.00 0.00 C ATOM 271 CG GLU A 17 13.286 6.437 4.758 1.00 0.00 C ATOM 272 CD GLU A 17 12.617 5.795 5.976 1.00 0.00 C ATOM 273 OE1 GLU A 17 11.408 5.635 5.947 1.00 0.00 O ATOM 274 OE2 GLU A 17 13.325 5.473 6.915 1.00 0.00 O ATOM 0 H GLU A 17 12.761 7.199 1.363 1.00 0.00 H new ATOM 0 HA GLU A 17 14.717 5.769 2.865 1.00 0.00 H new ATOM 0 HB2 GLU A 17 11.932 6.625 3.083 1.00 0.00 H new ATOM 0 HB3 GLU A 17 12.094 4.987 3.686 1.00 0.00 H new ATOM 0 HG2 GLU A 17 14.354 6.221 4.762 1.00 0.00 H new ATOM 0 HG3 GLU A 17 13.180 7.521 4.803 1.00 0.00 H new ATOM 281 N LEU A 18 12.956 3.981 0.785 1.00 0.00 N ATOM 282 CA LEU A 18 12.786 2.620 0.222 1.00 0.00 C ATOM 283 C LEU A 18 14.078 2.175 -0.419 1.00 0.00 C ATOM 284 O LEU A 18 14.542 1.077 -0.194 1.00 0.00 O ATOM 285 CB LEU A 18 11.699 2.623 -0.860 1.00 0.00 C ATOM 286 CG LEU A 18 10.510 3.522 -0.508 1.00 0.00 C ATOM 287 CD1 LEU A 18 9.374 3.207 -1.468 1.00 0.00 C ATOM 288 CD2 LEU A 18 10.018 3.299 0.918 1.00 0.00 C ATOM 0 H LEU A 18 12.536 4.727 0.231 1.00 0.00 H new ATOM 0 HA LEU A 18 12.504 1.946 1.031 1.00 0.00 H new ATOM 0 HB2 LEU A 18 12.133 2.956 -1.803 1.00 0.00 H new ATOM 0 HB3 LEU A 18 11.344 1.604 -1.014 1.00 0.00 H new ATOM 0 HG LEU A 18 10.834 4.560 -0.590 1.00 0.00 H new ATOM 0 HD11 LEU A 18 8.516 3.837 -1.235 1.00 0.00 H new ATOM 0 HD12 LEU A 18 9.698 3.399 -2.491 1.00 0.00 H new ATOM 0 HD13 LEU A 18 9.093 2.159 -1.367 1.00 0.00 H new ATOM 0 HD21 LEU A 18 9.174 3.959 1.119 1.00 0.00 H new ATOM 0 HD22 LEU A 18 9.703 2.262 1.036 1.00 0.00 H new ATOM 0 HD23 LEU A 18 10.824 3.516 1.619 1.00 0.00 H new ATOM 300 N LEU A 19 14.663 3.018 -1.221 1.00 0.00 N ATOM 301 CA LEU A 19 15.936 2.637 -1.875 1.00 0.00 C ATOM 302 C LEU A 19 17.112 2.856 -0.899 1.00 0.00 C ATOM 303 O LEU A 19 18.259 2.630 -1.235 1.00 0.00 O ATOM 304 CB LEU A 19 16.134 3.467 -3.151 1.00 0.00 C ATOM 305 CG LEU A 19 14.887 3.413 -4.076 1.00 0.00 C ATOM 306 CD1 LEU A 19 14.090 2.102 -3.913 1.00 0.00 C ATOM 307 CD2 LEU A 19 13.973 4.607 -3.771 1.00 0.00 C ATOM 0 H LEU A 19 14.314 3.949 -1.449 1.00 0.00 H new ATOM 0 HA LEU A 19 15.901 1.582 -2.147 1.00 0.00 H new ATOM 0 HB2 LEU A 19 16.342 4.503 -2.882 1.00 0.00 H new ATOM 0 HB3 LEU A 19 17.004 3.098 -3.693 1.00 0.00 H new ATOM 0 HG LEU A 19 15.241 3.455 -5.106 1.00 0.00 H new ATOM 0 HD11 LEU A 19 13.229 2.114 -4.581 1.00 0.00 H new ATOM 0 HD12 LEU A 19 14.729 1.254 -4.160 1.00 0.00 H new ATOM 0 HD13 LEU A 19 13.748 2.010 -2.882 1.00 0.00 H new ATOM 0 HD21 LEU A 19 13.098 4.570 -4.420 1.00 0.00 H new ATOM 0 HD22 LEU A 19 13.655 4.565 -2.729 1.00 0.00 H new ATOM 0 HD23 LEU A 19 14.516 5.535 -3.947 1.00 0.00 H new ATOM 319 N LYS A 20 16.829 3.288 0.311 1.00 0.00 N ATOM 320 CA LYS A 20 17.892 3.516 1.321 1.00 0.00 C ATOM 321 C LYS A 20 17.890 2.357 2.327 1.00 0.00 C ATOM 322 O LYS A 20 18.890 2.053 2.948 1.00 0.00 O ATOM 323 CB LYS A 20 17.581 4.821 2.054 1.00 0.00 C ATOM 324 CG LYS A 20 18.265 5.986 1.341 1.00 0.00 C ATOM 325 CD LYS A 20 18.305 7.203 2.268 1.00 0.00 C ATOM 326 CE LYS A 20 19.369 6.992 3.346 1.00 0.00 C ATOM 327 NZ LYS A 20 19.408 8.180 4.244 1.00 0.00 N ATOM 0 H LYS A 20 15.885 3.493 0.637 1.00 0.00 H new ATOM 0 HA LYS A 20 18.868 3.574 0.839 1.00 0.00 H new ATOM 0 HB2 LYS A 20 16.504 4.984 2.086 1.00 0.00 H new ATOM 0 HB3 LYS A 20 17.925 4.761 3.086 1.00 0.00 H new ATOM 0 HG2 LYS A 20 19.277 5.704 1.051 1.00 0.00 H new ATOM 0 HG3 LYS A 20 17.727 6.231 0.425 1.00 0.00 H new ATOM 0 HD2 LYS A 20 18.528 8.103 1.694 1.00 0.00 H new ATOM 0 HD3 LYS A 20 17.329 7.353 2.730 1.00 0.00 H new ATOM 0 HE2 LYS A 20 19.145 6.094 3.922 1.00 0.00 H new ATOM 0 HE3 LYS A 20 20.345 6.839 2.884 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 20.131 8.037 4.977 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 19.641 9.028 3.688 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 18.479 8.306 4.694 1.00 0.00 H new ATOM 341 N VAL A 21 16.760 1.718 2.487 1.00 0.00 N ATOM 342 CA VAL A 21 16.641 0.584 3.439 1.00 0.00 C ATOM 343 C VAL A 21 16.786 -0.732 2.677 1.00 0.00 C ATOM 344 O VAL A 21 17.288 -1.711 3.196 1.00 0.00 O ATOM 345 CB VAL A 21 15.272 0.655 4.113 1.00 0.00 C ATOM 346 CG1 VAL A 21 15.153 1.979 4.863 1.00 0.00 C ATOM 347 CG2 VAL A 21 14.157 0.565 3.064 1.00 0.00 C ATOM 0 H VAL A 21 15.900 1.942 1.986 1.00 0.00 H new ATOM 0 HA VAL A 21 17.423 0.640 4.196 1.00 0.00 H new ATOM 0 HB VAL A 21 15.172 -0.180 4.807 1.00 0.00 H new ATOM 0 HG11 VAL A 21 14.178 2.037 5.347 1.00 0.00 H new ATOM 0 HG12 VAL A 21 15.937 2.041 5.618 1.00 0.00 H new ATOM 0 HG13 VAL A 21 15.259 2.806 4.161 1.00 0.00 H new ATOM 0 HG21 VAL A 21 13.187 0.617 3.559 1.00 0.00 H new ATOM 0 HG22 VAL A 21 14.251 1.393 2.361 1.00 0.00 H new ATOM 0 HG23 VAL A 21 14.240 -0.379 2.525 1.00 0.00 H new ATOM 357 N LEU A 22 16.378 -0.747 1.431 1.00 0.00 N ATOM 358 CA LEU A 22 16.518 -1.977 0.604 1.00 0.00 C ATOM 359 C LEU A 22 18.018 -2.299 0.461 1.00 0.00 C ATOM 360 O LEU A 22 18.394 -3.397 0.100 1.00 0.00 O ATOM 361 CB LEU A 22 15.799 -1.760 -0.765 1.00 0.00 C ATOM 362 CG LEU A 22 16.702 -1.207 -1.902 1.00 0.00 C ATOM 363 CD1 LEU A 22 17.597 -0.059 -1.424 1.00 0.00 C ATOM 364 CD2 LEU A 22 17.569 -2.331 -2.467 1.00 0.00 C ATOM 0 H LEU A 22 15.952 0.047 0.953 1.00 0.00 H new ATOM 0 HA LEU A 22 16.042 -2.837 1.075 1.00 0.00 H new ATOM 0 HB2 LEU A 22 15.374 -2.710 -1.089 1.00 0.00 H new ATOM 0 HB3 LEU A 22 14.967 -1.072 -0.616 1.00 0.00 H new ATOM 0 HG LEU A 22 16.045 -0.813 -2.678 1.00 0.00 H new ATOM 0 HD11 LEU A 22 18.210 0.294 -2.253 1.00 0.00 H new ATOM 0 HD12 LEU A 22 16.976 0.758 -1.058 1.00 0.00 H new ATOM 0 HD13 LEU A 22 18.243 -0.412 -0.620 1.00 0.00 H new ATOM 0 HD21 LEU A 22 18.200 -1.938 -3.264 1.00 0.00 H new ATOM 0 HD22 LEU A 22 18.197 -2.740 -1.675 1.00 0.00 H new ATOM 0 HD23 LEU A 22 16.929 -3.118 -2.866 1.00 0.00 H new ATOM 376 N GLY A 23 18.873 -1.337 0.751 1.00 0.00 N ATOM 377 CA GLY A 23 20.324 -1.563 0.645 1.00 0.00 C ATOM 378 C GLY A 23 20.906 -0.584 -0.355 1.00 0.00 C ATOM 379 O GLY A 23 21.223 -0.944 -1.472 1.00 0.00 O ATOM 0 H GLY A 23 18.606 -0.402 1.058 1.00 0.00 H new ATOM 0 HA2 GLY A 23 20.797 -1.432 1.618 1.00 0.00 H new ATOM 0 HA3 GLY A 23 20.523 -2.587 0.329 1.00 0.00 H new ATOM 383 N VAL A 24 21.036 0.659 0.038 1.00 0.00 N ATOM 384 CA VAL A 24 21.595 1.703 -0.884 1.00 0.00 C ATOM 385 C VAL A 24 22.870 1.177 -1.581 1.00 0.00 C ATOM 386 O VAL A 24 23.680 0.486 -0.994 1.00 0.00 O ATOM 387 CB VAL A 24 21.851 3.004 -0.068 1.00 0.00 C ATOM 388 CG1 VAL A 24 23.348 3.355 0.054 1.00 0.00 C ATOM 389 CG2 VAL A 24 21.133 4.175 -0.748 1.00 0.00 C ATOM 0 H VAL A 24 20.778 1.000 0.964 1.00 0.00 H new ATOM 0 HA VAL A 24 20.883 1.934 -1.677 1.00 0.00 H new ATOM 0 HB VAL A 24 21.469 2.828 0.937 1.00 0.00 H new ATOM 0 HG11 VAL A 24 23.461 4.271 0.633 1.00 0.00 H new ATOM 0 HG12 VAL A 24 23.873 2.542 0.555 1.00 0.00 H new ATOM 0 HG13 VAL A 24 23.770 3.500 -0.940 1.00 0.00 H new ATOM 0 HG21 VAL A 24 21.309 5.089 -0.180 1.00 0.00 H new ATOM 0 HG22 VAL A 24 21.516 4.298 -1.761 1.00 0.00 H new ATOM 0 HG23 VAL A 24 20.063 3.972 -0.787 1.00 0.00 H new ATOM 399 N ASN A 25 23.022 1.505 -2.828 1.00 0.00 N ATOM 400 CA ASN A 25 24.204 1.048 -3.611 1.00 0.00 C ATOM 401 C ASN A 25 24.043 1.617 -5.010 1.00 0.00 C ATOM 402 O ASN A 25 23.721 0.913 -5.945 1.00 0.00 O ATOM 403 CB ASN A 25 24.239 -0.483 -3.663 1.00 0.00 C ATOM 404 CG ASN A 25 25.688 -0.958 -3.789 1.00 0.00 C ATOM 405 OD1 ASN A 25 26.598 -0.300 -3.323 1.00 0.00 O ATOM 406 ND2 ASN A 25 25.943 -2.081 -4.403 1.00 0.00 N ATOM 0 H ASN A 25 22.364 2.083 -3.352 1.00 0.00 H new ATOM 0 HA ASN A 25 25.135 1.385 -3.155 1.00 0.00 H new ATOM 0 HB2 ASN A 25 23.786 -0.898 -2.763 1.00 0.00 H new ATOM 0 HB3 ASN A 25 23.653 -0.842 -4.509 1.00 0.00 H new ATOM 0 HD21 ASN A 25 26.906 -2.407 -4.492 1.00 0.00 H new ATOM 0 HD22 ASN A 25 25.180 -2.633 -4.794 1.00 0.00 H new ATOM 413 N VAL A 26 24.212 2.914 -5.118 1.00 0.00 N ATOM 414 CA VAL A 26 24.033 3.657 -6.408 1.00 0.00 C ATOM 415 C VAL A 26 22.562 4.056 -6.568 1.00 0.00 C ATOM 416 O VAL A 26 22.235 4.879 -7.403 1.00 0.00 O ATOM 417 CB VAL A 26 24.484 2.850 -7.636 1.00 0.00 C ATOM 418 CG1 VAL A 26 24.444 3.753 -8.866 1.00 0.00 C ATOM 419 CG2 VAL A 26 25.910 2.338 -7.420 1.00 0.00 C ATOM 0 H VAL A 26 24.477 3.510 -4.334 1.00 0.00 H new ATOM 0 HA VAL A 26 24.669 4.541 -6.358 1.00 0.00 H new ATOM 0 HB VAL A 26 23.818 1.999 -7.782 1.00 0.00 H new ATOM 0 HG11 VAL A 26 24.763 3.188 -9.742 1.00 0.00 H new ATOM 0 HG12 VAL A 26 23.428 4.116 -9.018 1.00 0.00 H new ATOM 0 HG13 VAL A 26 25.113 4.600 -8.717 1.00 0.00 H new ATOM 0 HG21 VAL A 26 26.227 1.766 -8.292 1.00 0.00 H new ATOM 0 HG22 VAL A 26 26.582 3.184 -7.276 1.00 0.00 H new ATOM 0 HG23 VAL A 26 25.937 1.699 -6.537 1.00 0.00 H new ATOM 429 N MET A 27 21.671 3.522 -5.753 1.00 0.00 N ATOM 430 CA MET A 27 20.243 3.921 -5.845 1.00 0.00 C ATOM 431 C MET A 27 20.185 5.396 -5.460 1.00 0.00 C ATOM 432 O MET A 27 19.896 6.245 -6.280 1.00 0.00 O ATOM 433 CB MET A 27 19.403 3.093 -4.863 1.00 0.00 C ATOM 434 CG MET A 27 19.729 1.593 -4.995 1.00 0.00 C ATOM 435 SD MET A 27 18.400 0.745 -5.890 1.00 0.00 S ATOM 436 CE MET A 27 19.252 -0.836 -6.116 1.00 0.00 C ATOM 0 H MET A 27 21.882 2.830 -5.034 1.00 0.00 H new ATOM 0 HA MET A 27 19.848 3.754 -6.847 1.00 0.00 H new ATOM 0 HB2 MET A 27 19.597 3.424 -3.843 1.00 0.00 H new ATOM 0 HB3 MET A 27 18.343 3.258 -5.055 1.00 0.00 H new ATOM 0 HG2 MET A 27 20.674 1.463 -5.522 1.00 0.00 H new ATOM 0 HG3 MET A 27 19.852 1.151 -4.006 1.00 0.00 H new ATOM 0 HE1 MET A 27 18.603 -1.525 -6.657 1.00 0.00 H new ATOM 0 HE2 MET A 27 20.168 -0.678 -6.686 1.00 0.00 H new ATOM 0 HE3 MET A 27 19.499 -1.259 -5.142 1.00 0.00 H new ATOM 446 N LEU A 28 20.519 5.704 -4.217 1.00 0.00 N ATOM 447 CA LEU A 28 20.552 7.130 -3.742 1.00 0.00 C ATOM 448 C LEU A 28 19.330 7.894 -4.263 1.00 0.00 C ATOM 449 O LEU A 28 19.432 8.683 -5.183 1.00 0.00 O ATOM 450 CB LEU A 28 21.845 7.766 -4.266 1.00 0.00 C ATOM 451 CG LEU A 28 22.876 7.910 -3.134 1.00 0.00 C ATOM 452 CD1 LEU A 28 22.311 8.793 -2.018 1.00 0.00 C ATOM 453 CD2 LEU A 28 23.217 6.527 -2.567 1.00 0.00 C ATOM 0 H LEU A 28 20.772 5.016 -3.507 1.00 0.00 H new ATOM 0 HA LEU A 28 20.526 7.168 -2.653 1.00 0.00 H new ATOM 0 HB2 LEU A 28 22.259 7.153 -5.067 1.00 0.00 H new ATOM 0 HB3 LEU A 28 21.628 8.745 -4.694 1.00 0.00 H new ATOM 0 HG LEU A 28 23.778 8.373 -3.534 1.00 0.00 H new ATOM 0 HD11 LEU A 28 23.049 8.889 -1.221 1.00 0.00 H new ATOM 0 HD12 LEU A 28 22.078 9.780 -2.418 1.00 0.00 H new ATOM 0 HD13 LEU A 28 21.403 8.340 -1.620 1.00 0.00 H new ATOM 0 HD21 LEU A 28 23.948 6.633 -1.765 1.00 0.00 H new ATOM 0 HD22 LEU A 28 22.313 6.061 -2.175 1.00 0.00 H new ATOM 0 HD23 LEU A 28 23.633 5.902 -3.357 1.00 0.00 H new ATOM 465 N ARG A 29 18.166 7.617 -3.723 1.00 0.00 N ATOM 466 CA ARG A 29 16.925 8.274 -4.240 1.00 0.00 C ATOM 467 C ARG A 29 16.766 7.878 -5.719 1.00 0.00 C ATOM 468 O ARG A 29 16.169 8.582 -6.505 1.00 0.00 O ATOM 469 CB ARG A 29 17.044 9.797 -4.119 1.00 0.00 C ATOM 470 CG ARG A 29 15.646 10.419 -4.131 1.00 0.00 C ATOM 471 CD ARG A 29 15.721 11.854 -3.607 1.00 0.00 C ATOM 472 NE ARG A 29 14.389 12.258 -3.076 1.00 0.00 N ATOM 473 CZ ARG A 29 14.131 13.517 -2.853 1.00 0.00 C ATOM 474 NH1 ARG A 29 14.463 14.059 -1.713 1.00 0.00 N ATOM 475 NH2 ARG A 29 13.540 14.235 -3.769 1.00 0.00 N ATOM 0 H ARG A 29 18.023 6.967 -2.950 1.00 0.00 H new ATOM 0 HA ARG A 29 16.058 7.953 -3.662 1.00 0.00 H new ATOM 0 HB2 ARG A 29 17.563 10.060 -3.197 1.00 0.00 H new ATOM 0 HB3 ARG A 29 17.637 10.193 -4.943 1.00 0.00 H new ATOM 0 HG2 ARG A 29 15.242 10.411 -5.143 1.00 0.00 H new ATOM 0 HG3 ARG A 29 14.969 9.830 -3.513 1.00 0.00 H new ATOM 0 HD2 ARG A 29 16.475 11.927 -2.823 1.00 0.00 H new ATOM 0 HD3 ARG A 29 16.026 12.529 -4.407 1.00 0.00 H new ATOM 0 HE ARG A 29 13.679 11.550 -2.887 1.00 0.00 H new ATOM 0 HH11 ARG A 29 14.924 13.498 -0.997 1.00 0.00 H new ATOM 0 HH12 ARG A 29 14.261 15.044 -1.538 1.00 0.00 H new ATOM 0 HH21 ARG A 29 13.280 13.812 -4.660 1.00 0.00 H new ATOM 0 HH22 ARG A 29 13.338 15.219 -3.594 1.00 0.00 H new ATOM 489 N LYS A 30 17.339 6.749 -6.093 1.00 0.00 N ATOM 490 CA LYS A 30 17.288 6.248 -7.500 1.00 0.00 C ATOM 491 C LYS A 30 17.544 7.358 -8.526 1.00 0.00 C ATOM 492 O LYS A 30 17.163 7.230 -9.672 1.00 0.00 O ATOM 493 CB LYS A 30 15.943 5.575 -7.760 1.00 0.00 C ATOM 494 CG LYS A 30 16.108 4.063 -7.568 1.00 0.00 C ATOM 495 CD LYS A 30 14.752 3.374 -7.722 1.00 0.00 C ATOM 496 CE LYS A 30 14.548 2.964 -9.182 1.00 0.00 C ATOM 497 NZ LYS A 30 13.285 2.182 -9.305 1.00 0.00 N ATOM 0 H LYS A 30 17.854 6.141 -5.455 1.00 0.00 H new ATOM 0 HA LYS A 30 18.090 5.519 -7.620 1.00 0.00 H new ATOM 0 HB2 LYS A 30 15.187 5.963 -7.077 1.00 0.00 H new ATOM 0 HB3 LYS A 30 15.600 5.793 -8.771 1.00 0.00 H new ATOM 0 HG2 LYS A 30 16.813 3.668 -8.300 1.00 0.00 H new ATOM 0 HG3 LYS A 30 16.523 3.855 -6.582 1.00 0.00 H new ATOM 0 HD2 LYS A 30 14.703 2.497 -7.077 1.00 0.00 H new ATOM 0 HD3 LYS A 30 13.953 4.046 -7.407 1.00 0.00 H new ATOM 0 HE2 LYS A 30 14.504 3.849 -9.817 1.00 0.00 H new ATOM 0 HE3 LYS A 30 15.393 2.367 -9.525 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 13.145 1.903 -10.297 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 13.344 1.331 -8.711 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 12.483 2.766 -8.993 1.00 0.00 H new ATOM 511 N ILE A 31 18.227 8.419 -8.125 1.00 0.00 N ATOM 512 CA ILE A 31 18.574 9.558 -9.046 1.00 0.00 C ATOM 513 C ILE A 31 17.470 9.813 -10.085 1.00 0.00 C ATOM 514 O ILE A 31 17.734 10.161 -11.220 1.00 0.00 O ATOM 515 CB ILE A 31 19.894 9.232 -9.739 1.00 0.00 C ATOM 516 CG1 ILE A 31 20.948 8.845 -8.679 1.00 0.00 C ATOM 517 CG2 ILE A 31 20.370 10.452 -10.527 1.00 0.00 C ATOM 518 CD1 ILE A 31 21.205 10.020 -7.726 1.00 0.00 C ATOM 0 H ILE A 31 18.565 8.541 -7.171 1.00 0.00 H new ATOM 0 HA ILE A 31 18.669 10.471 -8.458 1.00 0.00 H new ATOM 0 HB ILE A 31 19.752 8.397 -10.425 1.00 0.00 H new ATOM 0 HG12 ILE A 31 20.604 7.979 -8.114 1.00 0.00 H new ATOM 0 HG13 ILE A 31 21.878 8.556 -9.170 1.00 0.00 H new ATOM 0 HG21 ILE A 31 21.313 10.220 -11.022 1.00 0.00 H new ATOM 0 HG22 ILE A 31 19.623 10.716 -11.275 1.00 0.00 H new ATOM 0 HG23 ILE A 31 20.515 11.291 -9.846 1.00 0.00 H new ATOM 0 HD11 ILE A 31 21.950 9.731 -6.985 1.00 0.00 H new ATOM 0 HD12 ILE A 31 21.571 10.876 -8.294 1.00 0.00 H new ATOM 0 HD13 ILE A 31 20.277 10.289 -7.222 1.00 0.00 H new ATOM 530 N ALA A 32 16.238 9.626 -9.691 1.00 0.00 N ATOM 531 CA ALA A 32 15.099 9.834 -10.625 1.00 0.00 C ATOM 532 C ALA A 32 13.792 9.681 -9.850 1.00 0.00 C ATOM 533 O ALA A 32 13.125 10.654 -9.556 1.00 0.00 O ATOM 534 CB ALA A 32 15.158 8.793 -11.746 1.00 0.00 C ATOM 0 H ALA A 32 15.972 9.335 -8.750 1.00 0.00 H new ATOM 0 HA ALA A 32 15.155 10.831 -11.062 1.00 0.00 H new ATOM 0 HB1 ALA A 32 14.323 8.947 -12.429 1.00 0.00 H new ATOM 0 HB2 ALA A 32 16.096 8.897 -12.290 1.00 0.00 H new ATOM 0 HB3 ALA A 32 15.097 7.793 -11.317 1.00 0.00 H new ATOM 540 N VAL A 33 13.425 8.465 -9.499 1.00 0.00 N ATOM 541 CA VAL A 33 12.160 8.248 -8.724 1.00 0.00 C ATOM 542 C VAL A 33 10.967 8.822 -9.511 1.00 0.00 C ATOM 543 O VAL A 33 11.144 9.522 -10.491 1.00 0.00 O ATOM 544 CB VAL A 33 12.315 8.941 -7.361 1.00 0.00 C ATOM 545 CG1 VAL A 33 11.041 8.790 -6.527 1.00 0.00 C ATOM 546 CG2 VAL A 33 13.488 8.295 -6.615 1.00 0.00 C ATOM 0 H VAL A 33 13.948 7.617 -9.717 1.00 0.00 H new ATOM 0 HA VAL A 33 11.973 7.185 -8.569 1.00 0.00 H new ATOM 0 HB VAL A 33 12.499 10.004 -7.520 1.00 0.00 H new ATOM 0 HG11 VAL A 33 11.174 9.288 -5.567 1.00 0.00 H new ATOM 0 HG12 VAL A 33 10.203 9.242 -7.058 1.00 0.00 H new ATOM 0 HG13 VAL A 33 10.837 7.732 -6.362 1.00 0.00 H new ATOM 0 HG21 VAL A 33 13.611 8.776 -5.645 1.00 0.00 H new ATOM 0 HG22 VAL A 33 13.287 7.233 -6.471 1.00 0.00 H new ATOM 0 HG23 VAL A 33 14.401 8.415 -7.198 1.00 0.00 H new ATOM 556 N ALA A 34 9.756 8.516 -9.109 1.00 0.00 N ATOM 557 CA ALA A 34 8.563 9.032 -9.848 1.00 0.00 C ATOM 558 C ALA A 34 8.156 10.415 -9.313 1.00 0.00 C ATOM 559 O ALA A 34 6.993 10.676 -9.069 1.00 0.00 O ATOM 560 CB ALA A 34 7.401 8.050 -9.672 1.00 0.00 C ATOM 0 H ALA A 34 9.544 7.931 -8.301 1.00 0.00 H new ATOM 0 HA ALA A 34 8.812 9.128 -10.905 1.00 0.00 H new ATOM 0 HB1 ALA A 34 6.527 8.420 -10.208 1.00 0.00 H new ATOM 0 HB2 ALA A 34 7.685 7.075 -10.069 1.00 0.00 H new ATOM 0 HB3 ALA A 34 7.163 7.954 -8.613 1.00 0.00 H new ATOM 566 N ALA A 35 9.103 11.310 -9.142 1.00 0.00 N ATOM 567 CA ALA A 35 8.780 12.682 -8.638 1.00 0.00 C ATOM 568 C ALA A 35 8.005 12.598 -7.319 1.00 0.00 C ATOM 569 O ALA A 35 7.694 11.525 -6.836 1.00 0.00 O ATOM 570 CB ALA A 35 7.930 13.415 -9.678 1.00 0.00 C ATOM 0 H ALA A 35 10.092 11.146 -9.332 1.00 0.00 H new ATOM 0 HA ALA A 35 9.710 13.224 -8.467 1.00 0.00 H new ATOM 0 HB1 ALA A 35 7.693 14.415 -9.315 1.00 0.00 H new ATOM 0 HB2 ALA A 35 8.485 13.491 -10.613 1.00 0.00 H new ATOM 0 HB3 ALA A 35 7.006 12.862 -9.848 1.00 0.00 H new ATOM 576 N ALA A 36 7.688 13.728 -6.741 1.00 0.00 N ATOM 577 CA ALA A 36 6.927 13.736 -5.459 1.00 0.00 C ATOM 578 C ALA A 36 5.582 14.430 -5.682 1.00 0.00 C ATOM 579 O ALA A 36 5.089 15.139 -4.826 1.00 0.00 O ATOM 580 CB ALA A 36 7.724 14.495 -4.396 1.00 0.00 C ATOM 0 H ALA A 36 7.926 14.650 -7.106 1.00 0.00 H new ATOM 0 HA ALA A 36 6.762 12.713 -5.122 1.00 0.00 H new ATOM 0 HB1 ALA A 36 7.167 14.501 -3.459 1.00 0.00 H new ATOM 0 HB2 ALA A 36 8.686 14.005 -4.244 1.00 0.00 H new ATOM 0 HB3 ALA A 36 7.887 15.521 -4.727 1.00 0.00 H new ATOM 586 N SER A 37 4.991 14.231 -6.834 1.00 0.00 N ATOM 587 CA SER A 37 3.678 14.875 -7.133 1.00 0.00 C ATOM 588 C SER A 37 2.625 14.391 -6.133 1.00 0.00 C ATOM 589 O SER A 37 2.946 13.809 -5.114 1.00 0.00 O ATOM 590 CB SER A 37 3.243 14.506 -8.553 1.00 0.00 C ATOM 591 OG SER A 37 4.346 14.659 -9.437 1.00 0.00 O ATOM 0 H SER A 37 5.364 13.647 -7.582 1.00 0.00 H new ATOM 0 HA SER A 37 3.779 15.957 -7.052 1.00 0.00 H new ATOM 0 HB2 SER A 37 2.881 13.478 -8.579 1.00 0.00 H new ATOM 0 HB3 SER A 37 2.417 15.143 -8.870 1.00 0.00 H new ATOM 0 HG SER A 37 4.071 14.422 -10.347 1.00 0.00 H new ATOM 597 N LYS A 38 1.371 14.634 -6.418 1.00 0.00 N ATOM 598 CA LYS A 38 0.288 14.197 -5.490 1.00 0.00 C ATOM 599 C LYS A 38 -0.631 13.186 -6.204 1.00 0.00 C ATOM 600 O LYS A 38 -1.491 13.589 -6.962 1.00 0.00 O ATOM 601 CB LYS A 38 -0.540 15.415 -5.071 1.00 0.00 C ATOM 602 CG LYS A 38 0.161 16.146 -3.920 1.00 0.00 C ATOM 603 CD LYS A 38 0.929 17.351 -4.469 1.00 0.00 C ATOM 604 CE LYS A 38 0.056 18.603 -4.367 1.00 0.00 C ATOM 605 NZ LYS A 38 0.648 19.690 -5.197 1.00 0.00 N ATOM 0 H LYS A 38 1.051 15.118 -7.257 1.00 0.00 H new ATOM 0 HA LYS A 38 0.733 13.729 -4.612 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -0.668 16.089 -5.918 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -1.536 15.100 -4.761 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -0.573 16.474 -3.184 1.00 0.00 H new ATOM 0 HG3 LYS A 38 0.845 15.469 -3.408 1.00 0.00 H new ATOM 0 HD2 LYS A 38 1.853 17.493 -3.909 1.00 0.00 H new ATOM 0 HD3 LYS A 38 1.210 17.174 -5.507 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -0.956 18.382 -4.706 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -0.019 18.924 -3.328 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 0.055 20.542 -5.128 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 1.606 19.906 -4.854 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 0.697 19.382 -6.189 1.00 0.00 H new ATOM 619 N PRO A 39 -0.447 11.898 -5.948 1.00 0.00 N ATOM 620 CA PRO A 39 -1.286 10.861 -6.576 1.00 0.00 C ATOM 621 C PRO A 39 -2.662 10.830 -5.906 1.00 0.00 C ATOM 622 O PRO A 39 -3.034 11.753 -5.205 1.00 0.00 O ATOM 623 CB PRO A 39 -0.516 9.561 -6.324 1.00 0.00 C ATOM 624 CG PRO A 39 0.404 9.828 -5.112 1.00 0.00 C ATOM 625 CD PRO A 39 0.585 11.355 -5.029 1.00 0.00 C ATOM 0 HA PRO A 39 -1.464 11.032 -7.638 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -1.200 8.738 -6.118 1.00 0.00 H new ATOM 0 HB3 PRO A 39 0.068 9.279 -7.200 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -0.039 9.439 -4.195 1.00 0.00 H new ATOM 0 HG3 PRO A 39 1.365 9.330 -5.237 1.00 0.00 H new ATOM 0 HD2 PRO A 39 0.442 11.718 -4.011 1.00 0.00 H new ATOM 0 HD3 PRO A 39 1.587 11.654 -5.336 1.00 0.00 H new ATOM 633 N ALA A 40 -3.421 9.784 -6.117 1.00 0.00 N ATOM 634 CA ALA A 40 -4.773 9.707 -5.492 1.00 0.00 C ATOM 635 C ALA A 40 -5.255 8.256 -5.451 1.00 0.00 C ATOM 636 O ALA A 40 -4.750 7.401 -6.154 1.00 0.00 O ATOM 637 CB ALA A 40 -5.759 10.541 -6.311 1.00 0.00 C ATOM 0 H ALA A 40 -3.162 8.983 -6.693 1.00 0.00 H new ATOM 0 HA ALA A 40 -4.714 10.093 -4.474 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -6.748 10.486 -5.856 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -5.427 11.579 -6.333 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -5.806 10.153 -7.329 1.00 0.00 H new ATOM 643 N VAL A 41 -6.237 7.985 -4.633 1.00 0.00 N ATOM 644 CA VAL A 41 -6.782 6.602 -4.530 1.00 0.00 C ATOM 645 C VAL A 41 -8.295 6.689 -4.318 1.00 0.00 C ATOM 646 O VAL A 41 -8.840 7.760 -4.126 1.00 0.00 O ATOM 647 CB VAL A 41 -6.097 5.864 -3.348 1.00 0.00 C ATOM 648 CG1 VAL A 41 -6.747 6.221 -2.005 1.00 0.00 C ATOM 649 CG2 VAL A 41 -6.183 4.347 -3.559 1.00 0.00 C ATOM 0 H VAL A 41 -6.688 8.670 -4.027 1.00 0.00 H new ATOM 0 HA VAL A 41 -6.582 6.042 -5.443 1.00 0.00 H new ATOM 0 HB VAL A 41 -5.055 6.182 -3.322 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -6.241 5.685 -1.202 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -6.664 7.294 -1.834 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -7.799 5.937 -2.023 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -5.700 3.836 -2.726 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -7.229 4.046 -3.613 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -5.681 4.080 -4.489 1.00 0.00 H new ATOM 659 N GLU A 42 -8.959 5.572 -4.314 1.00 0.00 N ATOM 660 CA GLU A 42 -10.422 5.584 -4.070 1.00 0.00 C ATOM 661 C GLU A 42 -10.835 4.240 -3.489 1.00 0.00 C ATOM 662 O GLU A 42 -10.740 3.216 -4.138 1.00 0.00 O ATOM 663 CB GLU A 42 -11.173 5.864 -5.370 1.00 0.00 C ATOM 664 CG GLU A 42 -10.794 4.820 -6.419 1.00 0.00 C ATOM 665 CD GLU A 42 -11.125 5.352 -7.814 1.00 0.00 C ATOM 666 OE1 GLU A 42 -12.247 5.155 -8.251 1.00 0.00 O ATOM 667 OE2 GLU A 42 -10.251 5.945 -8.424 1.00 0.00 O ATOM 0 H GLU A 42 -8.551 4.650 -4.469 1.00 0.00 H new ATOM 0 HA GLU A 42 -10.671 6.375 -3.362 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -12.248 5.841 -5.192 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -10.931 6.863 -5.733 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -9.731 4.589 -6.349 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -11.335 3.892 -6.235 1.00 0.00 H new ATOM 674 N ILE A 43 -11.280 4.240 -2.260 1.00 0.00 N ATOM 675 CA ILE A 43 -11.683 2.968 -1.618 1.00 0.00 C ATOM 676 C ILE A 43 -13.196 2.818 -1.686 1.00 0.00 C ATOM 677 O ILE A 43 -13.941 3.775 -1.597 1.00 0.00 O ATOM 678 CB ILE A 43 -11.205 2.956 -0.169 1.00 0.00 C ATOM 679 CG1 ILE A 43 -9.688 3.179 -0.148 1.00 0.00 C ATOM 680 CG2 ILE A 43 -11.533 1.605 0.474 1.00 0.00 C ATOM 681 CD1 ILE A 43 -9.189 3.276 1.295 1.00 0.00 C ATOM 0 H ILE A 43 -11.380 5.071 -1.677 1.00 0.00 H new ATOM 0 HA ILE A 43 -11.227 2.129 -2.144 1.00 0.00 H new ATOM 0 HB ILE A 43 -11.706 3.746 0.391 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -9.185 2.359 -0.660 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -9.440 4.092 -0.689 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -11.190 1.601 1.509 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -12.610 1.442 0.449 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -11.033 0.809 -0.077 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -8.111 3.434 1.297 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -9.679 4.112 1.794 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -9.421 2.351 1.823 1.00 0.00 H new ATOM 693 N LYS A 44 -13.639 1.613 -1.862 1.00 0.00 N ATOM 694 CA LYS A 44 -15.091 1.333 -1.964 1.00 0.00 C ATOM 695 C LYS A 44 -15.349 0.052 -1.181 1.00 0.00 C ATOM 696 O LYS A 44 -14.878 -1.003 -1.550 1.00 0.00 O ATOM 697 CB LYS A 44 -15.436 1.147 -3.445 1.00 0.00 C ATOM 698 CG LYS A 44 -14.931 2.358 -4.236 1.00 0.00 C ATOM 699 CD LYS A 44 -15.638 2.428 -5.586 1.00 0.00 C ATOM 700 CE LYS A 44 -15.275 1.207 -6.434 1.00 0.00 C ATOM 701 NZ LYS A 44 -16.478 0.752 -7.187 1.00 0.00 N ATOM 0 H LYS A 44 -13.042 0.790 -1.941 1.00 0.00 H new ATOM 0 HA LYS A 44 -15.702 2.141 -1.563 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -14.979 0.233 -3.825 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -16.514 1.040 -3.569 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -15.113 3.273 -3.672 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -13.854 2.283 -4.383 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -16.717 2.470 -5.438 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -15.352 3.341 -6.108 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -14.472 1.458 -7.127 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -14.906 0.404 -5.796 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -16.233 -0.078 -7.764 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -17.231 0.498 -6.517 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -16.810 1.518 -7.807 1.00 0.00 H new ATOM 715 N GLN A 45 -16.034 0.134 -0.070 1.00 0.00 N ATOM 716 CA GLN A 45 -16.228 -1.097 0.745 1.00 0.00 C ATOM 717 C GLN A 45 -17.638 -1.209 1.324 1.00 0.00 C ATOM 718 O GLN A 45 -18.296 -0.232 1.621 1.00 0.00 O ATOM 719 CB GLN A 45 -15.214 -1.066 1.889 1.00 0.00 C ATOM 720 CG GLN A 45 -15.425 0.188 2.742 1.00 0.00 C ATOM 721 CD GLN A 45 -16.264 -0.163 3.975 1.00 0.00 C ATOM 722 OE1 GLN A 45 -15.833 -0.922 4.820 1.00 0.00 O ATOM 723 NE2 GLN A 45 -17.453 0.357 4.114 1.00 0.00 N ATOM 0 H GLN A 45 -16.459 0.984 0.301 1.00 0.00 H new ATOM 0 HA GLN A 45 -16.084 -1.962 0.097 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -15.322 -1.958 2.506 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -14.201 -1.077 1.488 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -14.463 0.597 3.049 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -15.926 0.958 2.156 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -17.817 0.995 3.406 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -18.018 0.126 4.931 1.00 0.00 H new ATOM 732 N GLU A 46 -18.076 -2.425 1.506 1.00 0.00 N ATOM 733 CA GLU A 46 -19.412 -2.689 2.093 1.00 0.00 C ATOM 734 C GLU A 46 -19.245 -3.755 3.181 1.00 0.00 C ATOM 735 O GLU A 46 -19.353 -4.940 2.923 1.00 0.00 O ATOM 736 CB GLU A 46 -20.347 -3.210 1.004 1.00 0.00 C ATOM 737 CG GLU A 46 -21.796 -3.011 1.445 1.00 0.00 C ATOM 738 CD GLU A 46 -22.737 -3.440 0.319 1.00 0.00 C ATOM 739 OE1 GLU A 46 -22.833 -2.712 -0.655 1.00 0.00 O ATOM 740 OE2 GLU A 46 -23.347 -4.489 0.450 1.00 0.00 O ATOM 0 H GLU A 46 -17.548 -3.264 1.265 1.00 0.00 H new ATOM 0 HA GLU A 46 -19.834 -1.778 2.516 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -20.164 -2.682 0.068 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -20.153 -4.266 0.817 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -21.997 -3.595 2.343 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -21.969 -1.965 1.699 1.00 0.00 H new ATOM 747 N GLY A 47 -18.955 -3.343 4.390 1.00 0.00 N ATOM 748 CA GLY A 47 -18.754 -4.328 5.496 1.00 0.00 C ATOM 749 C GLY A 47 -17.340 -4.908 5.397 1.00 0.00 C ATOM 750 O GLY A 47 -16.374 -4.180 5.262 1.00 0.00 O ATOM 0 H GLY A 47 -18.849 -2.365 4.659 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -18.895 -3.843 6.462 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -19.494 -5.126 5.429 1.00 0.00 H new ATOM 754 N ASP A 48 -17.211 -6.211 5.455 1.00 0.00 N ATOM 755 CA ASP A 48 -15.863 -6.839 5.357 1.00 0.00 C ATOM 756 C ASP A 48 -15.389 -6.875 3.899 1.00 0.00 C ATOM 757 O ASP A 48 -14.283 -7.297 3.622 1.00 0.00 O ATOM 758 CB ASP A 48 -15.928 -8.259 5.902 1.00 0.00 C ATOM 759 CG ASP A 48 -17.020 -9.043 5.171 1.00 0.00 C ATOM 760 OD1 ASP A 48 -16.765 -9.480 4.061 1.00 0.00 O ATOM 761 OD2 ASP A 48 -18.092 -9.192 5.734 1.00 0.00 O ATOM 0 H ASP A 48 -17.985 -6.866 5.566 1.00 0.00 H new ATOM 0 HA ASP A 48 -15.157 -6.247 5.940 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -14.965 -8.753 5.773 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -16.136 -8.239 6.972 1.00 0.00 H new ATOM 766 N THR A 49 -16.195 -6.422 2.969 1.00 0.00 N ATOM 767 CA THR A 49 -15.761 -6.417 1.546 1.00 0.00 C ATOM 768 C THR A 49 -15.091 -5.072 1.261 1.00 0.00 C ATOM 769 O THR A 49 -15.569 -4.041 1.687 1.00 0.00 O ATOM 770 CB THR A 49 -16.983 -6.585 0.642 1.00 0.00 C ATOM 771 OG1 THR A 49 -17.675 -7.772 1.000 1.00 0.00 O ATOM 772 CG2 THR A 49 -16.535 -6.674 -0.815 1.00 0.00 C ATOM 0 H THR A 49 -17.132 -6.057 3.138 1.00 0.00 H new ATOM 0 HA THR A 49 -15.065 -7.234 1.355 1.00 0.00 H new ATOM 0 HB THR A 49 -17.645 -5.727 0.763 1.00 0.00 H new ATOM 0 HG1 THR A 49 -18.459 -7.880 0.423 1.00 0.00 H new ATOM 0 HG21 THR A 49 -17.408 -6.794 -1.457 1.00 0.00 H new ATOM 0 HG22 THR A 49 -16.005 -5.762 -1.089 1.00 0.00 H new ATOM 0 HG23 THR A 49 -15.872 -7.530 -0.940 1.00 0.00 H new ATOM 780 N PHE A 50 -13.987 -5.067 0.563 1.00 0.00 N ATOM 781 CA PHE A 50 -13.303 -3.774 0.272 1.00 0.00 C ATOM 782 C PHE A 50 -12.770 -3.750 -1.162 1.00 0.00 C ATOM 783 O PHE A 50 -12.474 -4.767 -1.758 1.00 0.00 O ATOM 784 CB PHE A 50 -12.130 -3.572 1.236 1.00 0.00 C ATOM 785 CG PHE A 50 -12.637 -3.613 2.650 1.00 0.00 C ATOM 786 CD1 PHE A 50 -12.795 -4.839 3.289 1.00 0.00 C ATOM 787 CD2 PHE A 50 -12.971 -2.429 3.313 1.00 0.00 C ATOM 788 CE1 PHE A 50 -13.290 -4.892 4.590 1.00 0.00 C ATOM 789 CE2 PHE A 50 -13.463 -2.477 4.623 1.00 0.00 C ATOM 790 CZ PHE A 50 -13.625 -3.714 5.259 1.00 0.00 C ATOM 0 H PHE A 50 -13.531 -5.897 0.184 1.00 0.00 H new ATOM 0 HA PHE A 50 -14.032 -2.974 0.397 1.00 0.00 H new ATOM 0 HB2 PHE A 50 -11.381 -4.349 1.083 1.00 0.00 H new ATOM 0 HB3 PHE A 50 -11.643 -2.617 1.040 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -12.533 -5.752 2.775 1.00 0.00 H new ATOM 0 HD2 PHE A 50 -12.850 -1.478 2.816 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -13.415 -5.846 5.081 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -13.717 -1.564 5.141 1.00 0.00 H new ATOM 0 HZ PHE A 50 -14.009 -3.756 6.267 1.00 0.00 H new ATOM 800 N TYR A 51 -12.618 -2.571 -1.686 1.00 0.00 N ATOM 801 CA TYR A 51 -12.070 -2.383 -3.054 1.00 0.00 C ATOM 802 C TYR A 51 -11.037 -1.267 -2.908 1.00 0.00 C ATOM 803 O TYR A 51 -11.188 -0.396 -2.071 1.00 0.00 O ATOM 804 CB TYR A 51 -13.232 -2.027 -4.017 1.00 0.00 C ATOM 805 CG TYR A 51 -12.817 -1.114 -5.159 1.00 0.00 C ATOM 806 CD1 TYR A 51 -12.600 0.247 -4.924 1.00 0.00 C ATOM 807 CD2 TYR A 51 -12.709 -1.620 -6.458 1.00 0.00 C ATOM 808 CE1 TYR A 51 -12.281 1.101 -5.975 1.00 0.00 C ATOM 809 CE2 TYR A 51 -12.374 -0.762 -7.516 1.00 0.00 C ATOM 810 CZ TYR A 51 -12.165 0.600 -7.274 1.00 0.00 C ATOM 811 OH TYR A 51 -11.863 1.453 -8.319 1.00 0.00 O ATOM 0 H TYR A 51 -12.858 -1.703 -1.208 1.00 0.00 H new ATOM 0 HA TYR A 51 -11.599 -3.271 -3.475 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -13.645 -2.947 -4.430 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -14.029 -1.546 -3.450 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -12.680 0.638 -3.920 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -12.883 -2.669 -6.646 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -12.123 2.153 -5.786 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -12.277 -1.153 -8.518 1.00 0.00 H new ATOM 0 HH TYR A 51 -11.702 2.354 -7.969 1.00 0.00 H new ATOM 821 N ILE A 52 -9.976 -1.300 -3.662 1.00 0.00 N ATOM 822 CA ILE A 52 -8.931 -0.247 -3.493 1.00 0.00 C ATOM 823 C ILE A 52 -8.287 0.066 -4.842 1.00 0.00 C ATOM 824 O ILE A 52 -7.561 -0.740 -5.390 1.00 0.00 O ATOM 825 CB ILE A 52 -7.856 -0.739 -2.501 1.00 0.00 C ATOM 826 CG1 ILE A 52 -8.521 -1.489 -1.329 1.00 0.00 C ATOM 827 CG2 ILE A 52 -7.085 0.463 -1.959 1.00 0.00 C ATOM 828 CD1 ILE A 52 -7.469 -1.977 -0.326 1.00 0.00 C ATOM 0 H ILE A 52 -9.785 -1.999 -4.380 1.00 0.00 H new ATOM 0 HA ILE A 52 -9.394 0.659 -3.102 1.00 0.00 H new ATOM 0 HB ILE A 52 -7.175 -1.416 -3.017 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -9.231 -0.832 -0.827 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -9.088 -2.338 -1.710 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -6.324 0.121 -1.257 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -6.607 0.991 -2.784 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -7.773 1.136 -1.448 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -7.962 -2.503 0.492 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -6.775 -2.653 -0.826 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -6.921 -1.123 0.071 1.00 0.00 H new ATOM 840 N LYS A 53 -8.550 1.230 -5.385 1.00 0.00 N ATOM 841 CA LYS A 53 -7.955 1.586 -6.705 1.00 0.00 C ATOM 842 C LYS A 53 -6.976 2.753 -6.552 1.00 0.00 C ATOM 843 O LYS A 53 -7.363 3.907 -6.581 1.00 0.00 O ATOM 844 CB LYS A 53 -9.066 1.968 -7.683 1.00 0.00 C ATOM 845 CG LYS A 53 -8.474 2.219 -9.076 1.00 0.00 C ATOM 846 CD LYS A 53 -9.451 3.058 -9.910 1.00 0.00 C ATOM 847 CE LYS A 53 -10.235 2.152 -10.867 1.00 0.00 C ATOM 848 NZ LYS A 53 -9.781 2.397 -12.265 1.00 0.00 N ATOM 0 H LYS A 53 -9.149 1.944 -4.971 1.00 0.00 H new ATOM 0 HA LYS A 53 -7.412 0.723 -7.090 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -9.808 1.171 -7.732 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -9.581 2.862 -7.331 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -7.519 2.737 -8.988 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -8.277 1.270 -9.575 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -10.140 3.589 -9.253 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -8.904 3.812 -10.476 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -10.082 1.106 -10.602 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -11.303 2.350 -10.780 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -10.312 1.783 -12.915 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -9.948 3.393 -12.515 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -8.765 2.187 -12.342 1.00 0.00 H new ATOM 862 N THR A 54 -5.709 2.454 -6.404 1.00 0.00 N ATOM 863 CA THR A 54 -4.684 3.530 -6.262 1.00 0.00 C ATOM 864 C THR A 54 -4.180 3.934 -7.642 1.00 0.00 C ATOM 865 O THR A 54 -3.249 3.349 -8.161 1.00 0.00 O ATOM 866 CB THR A 54 -3.506 3.010 -5.442 1.00 0.00 C ATOM 867 OG1 THR A 54 -3.986 2.267 -4.330 1.00 0.00 O ATOM 868 CG2 THR A 54 -2.668 4.193 -4.957 1.00 0.00 C ATOM 0 H THR A 54 -5.340 1.504 -6.375 1.00 0.00 H new ATOM 0 HA THR A 54 -5.132 4.389 -5.762 1.00 0.00 H new ATOM 0 HB THR A 54 -2.889 2.359 -6.061 1.00 0.00 H new ATOM 0 HG1 THR A 54 -3.227 1.934 -3.807 1.00 0.00 H new ATOM 0 HG21 THR A 54 -1.825 3.826 -4.371 1.00 0.00 H new ATOM 0 HG22 THR A 54 -2.296 4.752 -5.816 1.00 0.00 H new ATOM 0 HG23 THR A 54 -3.284 4.846 -4.338 1.00 0.00 H new ATOM 876 N SER A 55 -4.782 4.930 -8.240 1.00 0.00 N ATOM 877 CA SER A 55 -4.330 5.367 -9.589 1.00 0.00 C ATOM 878 C SER A 55 -4.212 6.891 -9.629 1.00 0.00 C ATOM 879 O SER A 55 -4.362 7.561 -8.624 1.00 0.00 O ATOM 880 CB SER A 55 -5.339 4.907 -10.641 1.00 0.00 C ATOM 881 OG SER A 55 -6.554 5.625 -10.472 1.00 0.00 O ATOM 0 H SER A 55 -5.565 5.456 -7.851 1.00 0.00 H new ATOM 0 HA SER A 55 -3.356 4.925 -9.800 1.00 0.00 H new ATOM 0 HB2 SER A 55 -4.940 5.074 -11.642 1.00 0.00 H new ATOM 0 HB3 SER A 55 -5.519 3.836 -10.545 1.00 0.00 H new ATOM 0 HG SER A 55 -7.203 5.334 -11.146 1.00 0.00 H new ATOM 887 N THR A 56 -3.942 7.439 -10.786 1.00 0.00 N ATOM 888 CA THR A 56 -3.810 8.920 -10.907 1.00 0.00 C ATOM 889 C THR A 56 -4.080 9.347 -12.353 1.00 0.00 C ATOM 890 O THR A 56 -4.776 10.314 -12.600 1.00 0.00 O ATOM 891 CB THR A 56 -2.396 9.343 -10.504 1.00 0.00 C ATOM 892 OG1 THR A 56 -2.223 10.728 -10.770 1.00 0.00 O ATOM 893 CG2 THR A 56 -1.373 8.538 -11.302 1.00 0.00 C ATOM 0 H THR A 56 -3.807 6.922 -11.655 1.00 0.00 H new ATOM 0 HA THR A 56 -4.534 9.400 -10.249 1.00 0.00 H new ATOM 0 HB THR A 56 -2.251 9.156 -9.440 1.00 0.00 H new ATOM 0 HG1 THR A 56 -1.318 11.000 -10.511 1.00 0.00 H new ATOM 0 HG21 THR A 56 -0.366 8.841 -11.013 1.00 0.00 H new ATOM 0 HG22 THR A 56 -1.505 7.476 -11.096 1.00 0.00 H new ATOM 0 HG23 THR A 56 -1.516 8.722 -12.367 1.00 0.00 H new ATOM 901 N THR A 57 -3.535 8.634 -13.309 1.00 0.00 N ATOM 902 CA THR A 57 -3.758 8.998 -14.740 1.00 0.00 C ATOM 903 C THR A 57 -3.459 7.792 -15.632 1.00 0.00 C ATOM 904 O THR A 57 -4.337 7.256 -16.281 1.00 0.00 O ATOM 905 CB THR A 57 -2.835 10.157 -15.126 1.00 0.00 C ATOM 906 OG1 THR A 57 -2.507 10.912 -13.968 1.00 0.00 O ATOM 907 CG2 THR A 57 -3.540 11.057 -16.142 1.00 0.00 C ATOM 0 H THR A 57 -2.945 7.816 -13.158 1.00 0.00 H new ATOM 0 HA THR A 57 -4.797 9.300 -14.875 1.00 0.00 H new ATOM 0 HB THR A 57 -1.921 9.759 -15.568 1.00 0.00 H new ATOM 0 HG1 THR A 57 -1.915 11.652 -14.217 1.00 0.00 H new ATOM 0 HG21 THR A 57 -2.882 11.882 -16.416 1.00 0.00 H new ATOM 0 HG22 THR A 57 -3.786 10.478 -17.032 1.00 0.00 H new ATOM 0 HG23 THR A 57 -4.455 11.454 -15.703 1.00 0.00 H new ATOM 915 N VAL A 58 -2.222 7.366 -15.669 1.00 0.00 N ATOM 916 CA VAL A 58 -1.847 6.196 -16.519 1.00 0.00 C ATOM 917 C VAL A 58 -2.635 4.960 -16.080 1.00 0.00 C ATOM 918 O VAL A 58 -3.391 5.001 -15.128 1.00 0.00 O ATOM 919 CB VAL A 58 -0.350 5.922 -16.373 1.00 0.00 C ATOM 920 CG1 VAL A 58 0.443 7.083 -16.974 1.00 0.00 C ATOM 921 CG2 VAL A 58 -0.004 5.783 -14.891 1.00 0.00 C ATOM 0 H VAL A 58 -1.452 7.781 -15.144 1.00 0.00 H new ATOM 0 HA VAL A 58 -2.080 6.419 -17.560 1.00 0.00 H new ATOM 0 HB VAL A 58 -0.095 5.000 -16.896 1.00 0.00 H new ATOM 0 HG11 VAL A 58 1.510 6.887 -16.870 1.00 0.00 H new ATOM 0 HG12 VAL A 58 0.194 7.185 -18.030 1.00 0.00 H new ATOM 0 HG13 VAL A 58 0.191 8.005 -16.451 1.00 0.00 H new ATOM 0 HG21 VAL A 58 1.063 5.588 -14.783 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -0.258 6.706 -14.370 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -0.570 4.956 -14.461 1.00 0.00 H new ATOM 931 N ARG A 59 -2.461 3.861 -16.771 1.00 0.00 N ATOM 932 CA ARG A 59 -3.194 2.613 -16.404 1.00 0.00 C ATOM 933 C ARG A 59 -2.778 2.173 -14.999 1.00 0.00 C ATOM 934 O ARG A 59 -1.622 2.262 -14.630 1.00 0.00 O ATOM 935 CB ARG A 59 -2.852 1.507 -17.405 1.00 0.00 C ATOM 936 CG ARG A 59 -3.880 1.506 -18.537 1.00 0.00 C ATOM 937 CD ARG A 59 -3.224 0.992 -19.821 1.00 0.00 C ATOM 938 NE ARG A 59 -2.982 -0.473 -19.704 1.00 0.00 N ATOM 939 CZ ARG A 59 -2.587 -1.155 -20.745 1.00 0.00 C ATOM 940 NH1 ARG A 59 -3.457 -1.557 -21.630 1.00 0.00 N ATOM 941 NH2 ARG A 59 -1.321 -1.433 -20.900 1.00 0.00 N ATOM 0 H ARG A 59 -1.840 3.775 -17.576 1.00 0.00 H new ATOM 0 HA ARG A 59 -4.267 2.803 -16.424 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -1.852 1.664 -17.808 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -2.846 0.539 -16.905 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -4.728 0.875 -18.272 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -4.267 2.513 -18.692 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -3.866 1.198 -20.677 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -2.283 1.514 -19.995 1.00 0.00 H new ATOM 0 HE ARG A 59 -3.125 -0.944 -18.810 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -4.446 -1.339 -21.509 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -3.148 -2.090 -22.443 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -0.641 -1.118 -20.208 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -1.012 -1.966 -21.713 1.00 0.00 H new ATOM 955 N THR A 60 -3.713 1.701 -14.216 1.00 0.00 N ATOM 956 CA THR A 60 -3.382 1.254 -12.832 1.00 0.00 C ATOM 957 C THR A 60 -4.213 0.020 -12.478 1.00 0.00 C ATOM 958 O THR A 60 -5.059 -0.408 -13.240 1.00 0.00 O ATOM 959 CB THR A 60 -3.694 2.382 -11.845 1.00 0.00 C ATOM 960 OG1 THR A 60 -3.482 3.634 -12.481 1.00 0.00 O ATOM 961 CG2 THR A 60 -2.778 2.267 -10.624 1.00 0.00 C ATOM 0 H THR A 60 -4.694 1.606 -14.477 1.00 0.00 H new ATOM 0 HA THR A 60 -2.323 1.003 -12.775 1.00 0.00 H new ATOM 0 HB THR A 60 -4.733 2.306 -11.523 1.00 0.00 H new ATOM 0 HG1 THR A 60 -2.920 4.200 -11.911 1.00 0.00 H new ATOM 0 HG21 THR A 60 -3.003 3.071 -9.924 1.00 0.00 H new ATOM 0 HG22 THR A 60 -2.940 1.306 -10.137 1.00 0.00 H new ATOM 0 HG23 THR A 60 -1.738 2.342 -10.941 1.00 0.00 H new ATOM 969 N THR A 61 -3.976 -0.553 -11.325 1.00 0.00 N ATOM 970 CA THR A 61 -4.747 -1.762 -10.910 1.00 0.00 C ATOM 971 C THR A 61 -5.441 -1.492 -9.574 1.00 0.00 C ATOM 972 O THR A 61 -5.190 -0.493 -8.925 1.00 0.00 O ATOM 973 CB THR A 61 -3.794 -2.950 -10.760 1.00 0.00 C ATOM 974 OG1 THR A 61 -4.504 -4.059 -10.226 1.00 0.00 O ATOM 975 CG2 THR A 61 -2.653 -2.572 -9.820 1.00 0.00 C ATOM 0 H THR A 61 -3.279 -0.234 -10.652 1.00 0.00 H new ATOM 0 HA THR A 61 -5.496 -1.992 -11.668 1.00 0.00 H new ATOM 0 HB THR A 61 -3.385 -3.216 -11.735 1.00 0.00 H new ATOM 0 HG1 THR A 61 -3.896 -4.822 -10.131 1.00 0.00 H new ATOM 0 HG21 THR A 61 -1.974 -3.418 -9.713 1.00 0.00 H new ATOM 0 HG22 THR A 61 -2.110 -1.721 -10.231 1.00 0.00 H new ATOM 0 HG23 THR A 61 -3.059 -2.307 -8.844 1.00 0.00 H new ATOM 983 N GLU A 62 -6.314 -2.375 -9.161 1.00 0.00 N ATOM 984 CA GLU A 62 -7.034 -2.181 -7.869 1.00 0.00 C ATOM 985 C GLU A 62 -7.394 -3.548 -7.280 1.00 0.00 C ATOM 986 O GLU A 62 -7.694 -4.478 -8.007 1.00 0.00 O ATOM 987 CB GLU A 62 -8.310 -1.358 -8.114 1.00 0.00 C ATOM 988 CG GLU A 62 -9.251 -2.087 -9.081 1.00 0.00 C ATOM 989 CD GLU A 62 -8.760 -1.896 -10.518 1.00 0.00 C ATOM 990 OE1 GLU A 62 -8.249 -0.828 -10.812 1.00 0.00 O ATOM 991 OE2 GLU A 62 -8.904 -2.822 -11.300 1.00 0.00 O ATOM 0 H GLU A 62 -6.559 -3.226 -9.667 1.00 0.00 H new ATOM 0 HA GLU A 62 -6.395 -1.646 -7.166 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -8.821 -1.180 -7.168 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -8.046 -0.382 -8.522 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -9.288 -3.149 -8.837 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -10.265 -1.701 -8.978 1.00 0.00 H new ATOM 998 N ILE A 63 -7.375 -3.680 -5.973 1.00 0.00 N ATOM 999 CA ILE A 63 -7.732 -4.995 -5.364 1.00 0.00 C ATOM 1000 C ILE A 63 -9.195 -4.990 -4.945 1.00 0.00 C ATOM 1001 O ILE A 63 -9.564 -4.451 -3.919 1.00 0.00 O ATOM 1002 CB ILE A 63 -6.841 -5.339 -4.153 1.00 0.00 C ATOM 1003 CG1 ILE A 63 -6.569 -4.098 -3.290 1.00 0.00 C ATOM 1004 CG2 ILE A 63 -5.522 -5.927 -4.654 1.00 0.00 C ATOM 1005 CD1 ILE A 63 -5.736 -4.492 -2.066 1.00 0.00 C ATOM 0 H ILE A 63 -7.131 -2.942 -5.312 1.00 0.00 H new ATOM 0 HA ILE A 63 -7.565 -5.762 -6.120 1.00 0.00 H new ATOM 0 HB ILE A 63 -7.362 -6.068 -3.532 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -6.040 -3.345 -3.875 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -7.511 -3.651 -2.972 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -4.887 -6.173 -3.803 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -5.722 -6.830 -5.230 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -5.015 -5.198 -5.286 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -5.545 -3.609 -1.456 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -6.281 -5.229 -1.477 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -4.788 -4.919 -2.393 1.00 0.00 H new ATOM 1017 N ASN A 64 -10.024 -5.620 -5.731 1.00 0.00 N ATOM 1018 CA ASN A 64 -11.473 -5.710 -5.381 1.00 0.00 C ATOM 1019 C ASN A 64 -11.657 -7.020 -4.622 1.00 0.00 C ATOM 1020 O ASN A 64 -12.109 -8.018 -5.149 1.00 0.00 O ATOM 1021 CB ASN A 64 -12.386 -5.675 -6.628 1.00 0.00 C ATOM 1022 CG ASN A 64 -11.734 -6.338 -7.859 1.00 0.00 C ATOM 1023 OD1 ASN A 64 -11.923 -5.878 -8.968 1.00 0.00 O ATOM 1024 ND2 ASN A 64 -10.976 -7.395 -7.724 1.00 0.00 N ATOM 0 H ASN A 64 -9.761 -6.078 -6.604 1.00 0.00 H new ATOM 0 HA ASN A 64 -11.760 -4.849 -4.778 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -13.324 -6.182 -6.401 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -12.632 -4.640 -6.865 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -10.550 -7.825 -8.545 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -10.811 -7.789 -6.798 1.00 0.00 H new ATOM 1031 N PHE A 65 -11.250 -7.016 -3.390 1.00 0.00 N ATOM 1032 CA PHE A 65 -11.306 -8.247 -2.561 1.00 0.00 C ATOM 1033 C PHE A 65 -12.280 -8.064 -1.390 1.00 0.00 C ATOM 1034 O PHE A 65 -13.109 -7.182 -1.382 1.00 0.00 O ATOM 1035 CB PHE A 65 -9.873 -8.490 -2.018 1.00 0.00 C ATOM 1036 CG PHE A 65 -9.518 -7.410 -0.998 1.00 0.00 C ATOM 1037 CD1 PHE A 65 -9.082 -6.153 -1.434 1.00 0.00 C ATOM 1038 CD2 PHE A 65 -9.675 -7.651 0.376 1.00 0.00 C ATOM 1039 CE1 PHE A 65 -8.802 -5.145 -0.514 1.00 0.00 C ATOM 1040 CE2 PHE A 65 -9.400 -6.637 1.299 1.00 0.00 C ATOM 1041 CZ PHE A 65 -8.964 -5.383 0.855 1.00 0.00 C ATOM 0 H PHE A 65 -10.874 -6.197 -2.912 1.00 0.00 H new ATOM 0 HA PHE A 65 -11.655 -9.093 -3.154 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -9.811 -9.475 -1.555 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -9.156 -8.478 -2.839 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -8.962 -5.964 -2.490 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -10.008 -8.619 0.720 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -8.460 -4.180 -0.858 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -9.524 -6.822 2.356 1.00 0.00 H new ATOM 0 HZ PHE A 65 -8.753 -4.600 1.569 1.00 0.00 H new ATOM 1051 N LYS A 66 -12.123 -8.885 -0.392 1.00 0.00 N ATOM 1052 CA LYS A 66 -12.937 -8.804 0.839 1.00 0.00 C ATOM 1053 C LYS A 66 -12.033 -9.330 1.944 1.00 0.00 C ATOM 1054 O LYS A 66 -11.515 -10.426 1.847 1.00 0.00 O ATOM 1055 CB LYS A 66 -14.196 -9.661 0.721 1.00 0.00 C ATOM 1056 CG LYS A 66 -13.834 -11.051 0.201 1.00 0.00 C ATOM 1057 CD LYS A 66 -15.113 -11.860 -0.028 1.00 0.00 C ATOM 1058 CE LYS A 66 -14.844 -12.968 -1.048 1.00 0.00 C ATOM 1059 NZ LYS A 66 -15.274 -12.513 -2.401 1.00 0.00 N ATOM 0 H LYS A 66 -11.434 -9.637 -0.385 1.00 0.00 H new ATOM 0 HA LYS A 66 -13.276 -7.787 1.034 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -14.683 -9.743 1.693 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -14.908 -9.185 0.047 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -13.272 -10.968 -0.729 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -13.191 -11.563 0.917 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -15.455 -12.293 0.912 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -15.909 -11.207 -0.387 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -13.783 -13.219 -1.057 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -15.383 -13.873 -0.769 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -15.091 -13.266 -3.095 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -16.291 -12.294 -2.387 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -14.740 -11.661 -2.667 1.00 0.00 H new ATOM 1073 N VAL A 67 -11.782 -8.537 2.955 1.00 0.00 N ATOM 1074 CA VAL A 67 -10.846 -8.951 4.051 1.00 0.00 C ATOM 1075 C VAL A 67 -11.109 -10.403 4.483 1.00 0.00 C ATOM 1076 O VAL A 67 -12.227 -10.882 4.461 1.00 0.00 O ATOM 1077 CB VAL A 67 -10.995 -7.997 5.235 1.00 0.00 C ATOM 1078 CG1 VAL A 67 -10.040 -8.420 6.353 1.00 0.00 C ATOM 1079 CG2 VAL A 67 -10.630 -6.579 4.791 1.00 0.00 C ATOM 0 H VAL A 67 -12.189 -7.609 3.071 1.00 0.00 H new ATOM 0 HA VAL A 67 -9.823 -8.901 3.678 1.00 0.00 H new ATOM 0 HB VAL A 67 -12.024 -8.025 5.593 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -10.145 -7.740 7.198 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -10.279 -9.435 6.671 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -9.014 -8.387 5.987 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -10.735 -5.896 5.634 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -9.599 -6.563 4.437 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -11.295 -6.267 3.986 1.00 0.00 H new ATOM 1089 N GLY A 68 -10.064 -11.102 4.824 1.00 0.00 N ATOM 1090 CA GLY A 68 -10.198 -12.534 5.206 1.00 0.00 C ATOM 1091 C GLY A 68 -9.856 -13.407 3.986 1.00 0.00 C ATOM 1092 O GLY A 68 -10.116 -14.596 3.976 1.00 0.00 O ATOM 0 H GLY A 68 -9.112 -10.738 4.855 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -9.531 -12.767 6.036 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -11.213 -12.741 5.545 1.00 0.00 H new ATOM 1096 N GLU A 69 -9.274 -12.824 2.954 1.00 0.00 N ATOM 1097 CA GLU A 69 -8.917 -13.609 1.742 1.00 0.00 C ATOM 1098 C GLU A 69 -7.582 -13.103 1.183 1.00 0.00 C ATOM 1099 O GLU A 69 -7.048 -12.103 1.632 1.00 0.00 O ATOM 1100 CB GLU A 69 -10.010 -13.442 0.684 1.00 0.00 C ATOM 1101 CG GLU A 69 -11.226 -14.290 1.065 1.00 0.00 C ATOM 1102 CD GLU A 69 -11.007 -15.732 0.605 1.00 0.00 C ATOM 1103 OE1 GLU A 69 -9.977 -16.291 0.943 1.00 0.00 O ATOM 1104 OE2 GLU A 69 -11.874 -16.253 -0.078 1.00 0.00 O ATOM 0 H GLU A 69 -9.035 -11.833 2.910 1.00 0.00 H new ATOM 0 HA GLU A 69 -8.826 -14.663 2.005 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -10.296 -12.393 0.604 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -9.634 -13.745 -0.293 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -11.380 -14.261 2.144 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -12.126 -13.883 0.604 1.00 0.00 H new ATOM 1111 N GLU A 70 -7.033 -13.800 0.222 1.00 0.00 N ATOM 1112 CA GLU A 70 -5.719 -13.388 -0.363 1.00 0.00 C ATOM 1113 C GLU A 70 -5.847 -13.029 -1.837 1.00 0.00 C ATOM 1114 O GLU A 70 -6.818 -13.347 -2.496 1.00 0.00 O ATOM 1115 CB GLU A 70 -4.724 -14.551 -0.278 1.00 0.00 C ATOM 1116 CG GLU A 70 -5.391 -15.849 -0.739 1.00 0.00 C ATOM 1117 CD GLU A 70 -5.914 -16.617 0.476 1.00 0.00 C ATOM 1118 OE1 GLU A 70 -5.098 -17.082 1.254 1.00 0.00 O ATOM 1119 OE2 GLU A 70 -7.122 -16.727 0.608 1.00 0.00 O ATOM 0 H GLU A 70 -7.440 -14.642 -0.186 1.00 0.00 H new ATOM 0 HA GLU A 70 -5.379 -12.521 0.204 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -3.853 -14.340 -0.898 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -4.367 -14.660 0.746 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -6.211 -15.626 -1.421 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -4.676 -16.461 -1.289 1.00 0.00 H new ATOM 1126 N PHE A 71 -4.814 -12.425 -2.365 1.00 0.00 N ATOM 1127 CA PHE A 71 -4.779 -12.096 -3.812 1.00 0.00 C ATOM 1128 C PHE A 71 -3.538 -12.770 -4.374 1.00 0.00 C ATOM 1129 O PHE A 71 -2.846 -13.483 -3.676 1.00 0.00 O ATOM 1130 CB PHE A 71 -4.658 -10.580 -4.091 1.00 0.00 C ATOM 1131 CG PHE A 71 -5.266 -9.719 -3.006 1.00 0.00 C ATOM 1132 CD1 PHE A 71 -6.470 -10.071 -2.386 1.00 0.00 C ATOM 1133 CD2 PHE A 71 -4.619 -8.529 -2.647 1.00 0.00 C ATOM 1134 CE1 PHE A 71 -7.018 -9.231 -1.404 1.00 0.00 C ATOM 1135 CE2 PHE A 71 -5.173 -7.692 -1.678 1.00 0.00 C ATOM 1136 CZ PHE A 71 -6.366 -8.041 -1.058 1.00 0.00 C ATOM 0 H PHE A 71 -3.984 -12.144 -1.843 1.00 0.00 H new ATOM 0 HA PHE A 71 -5.711 -12.433 -4.266 1.00 0.00 H new ATOM 0 HB2 PHE A 71 -3.605 -10.322 -4.202 1.00 0.00 H new ATOM 0 HB3 PHE A 71 -5.144 -10.353 -5.040 1.00 0.00 H new ATOM 0 HD1 PHE A 71 -6.975 -10.985 -2.662 1.00 0.00 H new ATOM 0 HD2 PHE A 71 -3.688 -8.259 -3.122 1.00 0.00 H new ATOM 0 HE1 PHE A 71 -7.942 -9.502 -0.915 1.00 0.00 H new ATOM 0 HE2 PHE A 71 -4.674 -6.772 -1.410 1.00 0.00 H new ATOM 0 HZ PHE A 71 -6.792 -7.393 -0.307 1.00 0.00 H new ATOM 1146 N GLU A 72 -3.235 -12.526 -5.611 1.00 0.00 N ATOM 1147 CA GLU A 72 -2.012 -13.124 -6.209 1.00 0.00 C ATOM 1148 C GLU A 72 -1.149 -12.008 -6.775 1.00 0.00 C ATOM 1149 O GLU A 72 -1.626 -10.922 -7.049 1.00 0.00 O ATOM 1150 CB GLU A 72 -2.376 -14.089 -7.326 1.00 0.00 C ATOM 1151 CG GLU A 72 -3.360 -15.124 -6.793 1.00 0.00 C ATOM 1152 CD GLU A 72 -4.115 -15.766 -7.959 1.00 0.00 C ATOM 1153 OE1 GLU A 72 -4.643 -15.028 -8.774 1.00 0.00 O ATOM 1154 OE2 GLU A 72 -4.151 -16.984 -8.016 1.00 0.00 O ATOM 0 H GLU A 72 -3.782 -11.936 -6.239 1.00 0.00 H new ATOM 0 HA GLU A 72 -1.471 -13.673 -5.438 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -2.818 -13.547 -8.162 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -1.480 -14.582 -7.703 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -2.828 -15.888 -6.227 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -4.064 -14.652 -6.107 1.00 0.00 H new ATOM 1161 N GLU A 73 0.113 -12.268 -6.948 1.00 0.00 N ATOM 1162 CA GLU A 73 1.019 -11.215 -7.496 1.00 0.00 C ATOM 1163 C GLU A 73 2.345 -11.826 -7.944 1.00 0.00 C ATOM 1164 O GLU A 73 2.526 -13.027 -7.945 1.00 0.00 O ATOM 1165 CB GLU A 73 1.281 -10.160 -6.410 1.00 0.00 C ATOM 1166 CG GLU A 73 0.494 -8.882 -6.723 1.00 0.00 C ATOM 1167 CD GLU A 73 1.410 -7.870 -7.416 1.00 0.00 C ATOM 1168 OE1 GLU A 73 2.545 -7.738 -6.988 1.00 0.00 O ATOM 1169 OE2 GLU A 73 0.961 -7.246 -8.363 1.00 0.00 O ATOM 0 H GLU A 73 0.560 -13.160 -6.736 1.00 0.00 H new ATOM 0 HA GLU A 73 0.541 -10.752 -8.359 1.00 0.00 H new ATOM 0 HB2 GLU A 73 0.987 -10.549 -5.435 1.00 0.00 H new ATOM 0 HB3 GLU A 73 2.347 -9.937 -6.357 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -0.357 -9.115 -7.363 1.00 0.00 H new ATOM 0 HG3 GLU A 73 0.094 -8.455 -5.803 1.00 0.00 H new ATOM 1176 N GLN A 74 3.268 -10.986 -8.325 1.00 0.00 N ATOM 1177 CA GLN A 74 4.607 -11.468 -8.778 1.00 0.00 C ATOM 1178 C GLN A 74 5.671 -10.447 -8.369 1.00 0.00 C ATOM 1179 O GLN A 74 5.454 -9.252 -8.451 1.00 0.00 O ATOM 1180 CB GLN A 74 4.616 -11.613 -10.298 1.00 0.00 C ATOM 1181 CG GLN A 74 3.632 -12.707 -10.714 1.00 0.00 C ATOM 1182 CD GLN A 74 3.597 -12.810 -12.240 1.00 0.00 C ATOM 1183 OE1 GLN A 74 3.587 -11.810 -12.929 1.00 0.00 O ATOM 1184 NE2 GLN A 74 3.578 -13.988 -12.801 1.00 0.00 N ATOM 0 H GLN A 74 3.151 -9.973 -8.342 1.00 0.00 H new ATOM 0 HA GLN A 74 4.818 -12.434 -8.319 1.00 0.00 H new ATOM 0 HB2 GLN A 74 4.343 -10.667 -10.765 1.00 0.00 H new ATOM 0 HB3 GLN A 74 5.619 -11.861 -10.644 1.00 0.00 H new ATOM 0 HG2 GLN A 74 3.930 -13.662 -10.281 1.00 0.00 H new ATOM 0 HG3 GLN A 74 2.637 -12.480 -10.331 1.00 0.00 H new ATOM 0 HE21 GLN A 74 3.586 -14.828 -12.223 1.00 0.00 H new ATOM 0 HE22 GLN A 74 3.555 -14.068 -13.818 1.00 0.00 H new ATOM 1193 N THR A 75 6.815 -10.906 -7.927 1.00 0.00 N ATOM 1194 CA THR A 75 7.890 -9.957 -7.509 1.00 0.00 C ATOM 1195 C THR A 75 8.364 -9.162 -8.723 1.00 0.00 C ATOM 1196 O THR A 75 7.736 -9.176 -9.765 1.00 0.00 O ATOM 1197 CB THR A 75 9.069 -10.732 -6.920 1.00 0.00 C ATOM 1198 OG1 THR A 75 9.628 -11.574 -7.918 1.00 0.00 O ATOM 1199 CG2 THR A 75 8.585 -11.572 -5.744 1.00 0.00 C ATOM 0 H THR A 75 7.050 -11.895 -7.838 1.00 0.00 H new ATOM 0 HA THR A 75 7.494 -9.277 -6.754 1.00 0.00 H new ATOM 0 HB THR A 75 9.831 -10.034 -6.573 1.00 0.00 H new ATOM 0 HG1 THR A 75 9.549 -12.510 -7.638 1.00 0.00 H new ATOM 0 HG21 THR A 75 9.424 -12.126 -5.322 1.00 0.00 H new ATOM 0 HG22 THR A 75 8.161 -10.919 -4.981 1.00 0.00 H new ATOM 0 HG23 THR A 75 7.823 -12.273 -6.086 1.00 0.00 H new ATOM 1207 N VAL A 76 9.467 -8.468 -8.596 1.00 0.00 N ATOM 1208 CA VAL A 76 9.983 -7.670 -9.741 1.00 0.00 C ATOM 1209 C VAL A 76 10.973 -8.511 -10.551 1.00 0.00 C ATOM 1210 O VAL A 76 11.101 -8.347 -11.750 1.00 0.00 O ATOM 1211 CB VAL A 76 10.684 -6.417 -9.222 1.00 0.00 C ATOM 1212 CG1 VAL A 76 11.063 -5.518 -10.400 1.00 0.00 C ATOM 1213 CG2 VAL A 76 9.745 -5.656 -8.282 1.00 0.00 C ATOM 0 H VAL A 76 10.030 -8.422 -7.747 1.00 0.00 H new ATOM 0 HA VAL A 76 9.149 -7.379 -10.379 1.00 0.00 H new ATOM 0 HB VAL A 76 11.585 -6.705 -8.680 1.00 0.00 H new ATOM 0 HG11 VAL A 76 11.563 -4.624 -10.029 1.00 0.00 H new ATOM 0 HG12 VAL A 76 11.733 -6.058 -11.069 1.00 0.00 H new ATOM 0 HG13 VAL A 76 10.163 -5.231 -10.943 1.00 0.00 H new ATOM 0 HG21 VAL A 76 10.247 -4.762 -7.912 1.00 0.00 H new ATOM 0 HG22 VAL A 76 8.843 -5.369 -8.823 1.00 0.00 H new ATOM 0 HG23 VAL A 76 9.476 -6.295 -7.441 1.00 0.00 H new ATOM 1223 N ASP A 77 11.672 -9.410 -9.904 1.00 0.00 N ATOM 1224 CA ASP A 77 12.656 -10.265 -10.631 1.00 0.00 C ATOM 1225 C ASP A 77 13.170 -11.364 -9.698 1.00 0.00 C ATOM 1226 O ASP A 77 14.219 -11.237 -9.095 1.00 0.00 O ATOM 1227 CB ASP A 77 13.830 -9.403 -11.101 1.00 0.00 C ATOM 1228 CG ASP A 77 14.652 -10.178 -12.132 1.00 0.00 C ATOM 1229 OD1 ASP A 77 15.231 -11.187 -11.763 1.00 0.00 O ATOM 1230 OD2 ASP A 77 14.689 -9.750 -13.274 1.00 0.00 O ATOM 0 H ASP A 77 11.602 -9.588 -8.902 1.00 0.00 H new ATOM 0 HA ASP A 77 12.171 -10.722 -11.494 1.00 0.00 H new ATOM 0 HB2 ASP A 77 13.461 -8.475 -11.538 1.00 0.00 H new ATOM 0 HB3 ASP A 77 14.457 -9.129 -10.252 1.00 0.00 H new ATOM 1235 N GLY A 78 12.437 -12.442 -9.579 1.00 0.00 N ATOM 1236 CA GLY A 78 12.872 -13.558 -8.689 1.00 0.00 C ATOM 1237 C GLY A 78 11.787 -14.635 -8.656 1.00 0.00 C ATOM 1238 O GLY A 78 11.682 -15.450 -9.553 1.00 0.00 O ATOM 0 H GLY A 78 11.552 -12.597 -10.063 1.00 0.00 H new ATOM 0 HA2 GLY A 78 13.809 -13.982 -9.050 1.00 0.00 H new ATOM 0 HA3 GLY A 78 13.059 -13.183 -7.683 1.00 0.00 H new ATOM 1242 N ARG A 79 10.977 -14.639 -7.628 1.00 0.00 N ATOM 1243 CA ARG A 79 9.890 -15.656 -7.525 1.00 0.00 C ATOM 1244 C ARG A 79 8.534 -14.929 -7.494 1.00 0.00 C ATOM 1245 O ARG A 79 8.503 -13.720 -7.429 1.00 0.00 O ATOM 1246 CB ARG A 79 10.079 -16.466 -6.234 1.00 0.00 C ATOM 1247 CG ARG A 79 10.511 -17.895 -6.577 1.00 0.00 C ATOM 1248 CD ARG A 79 11.323 -18.476 -5.418 1.00 0.00 C ATOM 1249 NE ARG A 79 12.579 -17.693 -5.248 1.00 0.00 N ATOM 1250 CZ ARG A 79 13.184 -17.671 -4.092 1.00 0.00 C ATOM 1251 NH1 ARG A 79 12.749 -16.889 -3.142 1.00 0.00 N ATOM 1252 NH2 ARG A 79 14.224 -18.432 -3.886 1.00 0.00 N ATOM 0 H ARG A 79 11.023 -13.978 -6.853 1.00 0.00 H new ATOM 0 HA ARG A 79 9.922 -16.332 -8.379 1.00 0.00 H new ATOM 0 HB2 ARG A 79 10.830 -15.991 -5.602 1.00 0.00 H new ATOM 0 HB3 ARG A 79 9.149 -16.484 -5.666 1.00 0.00 H new ATOM 0 HG2 ARG A 79 9.635 -18.515 -6.768 1.00 0.00 H new ATOM 0 HG3 ARG A 79 11.107 -17.897 -7.489 1.00 0.00 H new ATOM 0 HD2 ARG A 79 10.737 -18.447 -4.499 1.00 0.00 H new ATOM 0 HD3 ARG A 79 11.558 -19.522 -5.613 1.00 0.00 H new ATOM 0 HE ARG A 79 12.966 -17.174 -6.036 1.00 0.00 H new ATOM 0 HH11 ARG A 79 11.936 -16.295 -3.303 1.00 0.00 H new ATOM 0 HH12 ARG A 79 13.222 -16.872 -2.239 1.00 0.00 H new ATOM 0 HH21 ARG A 79 14.564 -19.044 -4.628 1.00 0.00 H new ATOM 0 HH22 ARG A 79 14.697 -18.415 -2.983 1.00 0.00 H new ATOM 1266 N PRO A 80 7.442 -15.670 -7.536 1.00 0.00 N ATOM 1267 CA PRO A 80 6.102 -15.061 -7.505 1.00 0.00 C ATOM 1268 C PRO A 80 5.771 -14.594 -6.084 1.00 0.00 C ATOM 1269 O PRO A 80 6.598 -14.669 -5.194 1.00 0.00 O ATOM 1270 CB PRO A 80 5.174 -16.188 -7.963 1.00 0.00 C ATOM 1271 CG PRO A 80 5.931 -17.511 -7.703 1.00 0.00 C ATOM 1272 CD PRO A 80 7.426 -17.153 -7.614 1.00 0.00 C ATOM 0 HA PRO A 80 6.011 -14.179 -8.139 1.00 0.00 H new ATOM 0 HB2 PRO A 80 4.233 -16.164 -7.413 1.00 0.00 H new ATOM 0 HB3 PRO A 80 4.928 -16.083 -9.020 1.00 0.00 H new ATOM 0 HG2 PRO A 80 5.589 -17.978 -6.779 1.00 0.00 H new ATOM 0 HG3 PRO A 80 5.751 -18.225 -8.507 1.00 0.00 H new ATOM 0 HD2 PRO A 80 7.892 -17.603 -6.737 1.00 0.00 H new ATOM 0 HD3 PRO A 80 7.974 -17.512 -8.485 1.00 0.00 H new ATOM 1280 N CYS A 81 4.577 -14.103 -5.867 1.00 0.00 N ATOM 1281 CA CYS A 81 4.201 -13.619 -4.505 1.00 0.00 C ATOM 1282 C CYS A 81 2.713 -13.290 -4.449 1.00 0.00 C ATOM 1283 O CYS A 81 2.156 -12.699 -5.352 1.00 0.00 O ATOM 1284 CB CYS A 81 5.012 -12.358 -4.169 1.00 0.00 C ATOM 1285 SG CYS A 81 4.725 -11.078 -5.418 1.00 0.00 S ATOM 0 H CYS A 81 3.847 -14.017 -6.574 1.00 0.00 H new ATOM 0 HA CYS A 81 4.417 -14.405 -3.781 1.00 0.00 H new ATOM 0 HB2 CYS A 81 4.728 -11.986 -3.185 1.00 0.00 H new ATOM 0 HB3 CYS A 81 6.074 -12.601 -4.124 1.00 0.00 H new ATOM 0 HG CYS A 81 5.415 -10.018 -5.119 1.00 0.00 H new ATOM 1291 N LYS A 82 2.084 -13.659 -3.374 1.00 0.00 N ATOM 1292 CA LYS A 82 0.636 -13.375 -3.197 1.00 0.00 C ATOM 1293 C LYS A 82 0.466 -12.398 -2.038 1.00 0.00 C ATOM 1294 O LYS A 82 1.430 -11.878 -1.506 1.00 0.00 O ATOM 1295 CB LYS A 82 -0.097 -14.674 -2.881 1.00 0.00 C ATOM 1296 CG LYS A 82 0.518 -15.344 -1.638 1.00 0.00 C ATOM 1297 CD LYS A 82 -0.154 -16.705 -1.358 1.00 0.00 C ATOM 1298 CE LYS A 82 -1.673 -16.621 -1.564 1.00 0.00 C ATOM 1299 NZ LYS A 82 -2.357 -17.600 -0.672 1.00 0.00 N ATOM 0 H LYS A 82 2.519 -14.154 -2.596 1.00 0.00 H new ATOM 0 HA LYS A 82 0.225 -12.942 -4.109 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -1.154 -14.471 -2.708 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -0.038 -15.350 -3.734 1.00 0.00 H new ATOM 0 HG2 LYS A 82 1.588 -15.486 -1.788 1.00 0.00 H new ATOM 0 HG3 LYS A 82 0.402 -14.691 -0.773 1.00 0.00 H new ATOM 0 HD2 LYS A 82 0.265 -17.464 -2.019 1.00 0.00 H new ATOM 0 HD3 LYS A 82 0.061 -17.018 -0.336 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -2.023 -15.612 -1.348 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -1.920 -16.829 -2.605 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -3.176 -18.008 -1.167 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -1.694 -18.359 -0.416 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -2.680 -17.117 0.191 1.00 0.00 H new ATOM 1313 N SER A 83 -0.750 -12.144 -1.652 1.00 0.00 N ATOM 1314 CA SER A 83 -0.999 -11.195 -0.527 1.00 0.00 C ATOM 1315 C SER A 83 -2.181 -11.661 0.309 1.00 0.00 C ATOM 1316 O SER A 83 -2.807 -12.653 0.010 1.00 0.00 O ATOM 1317 CB SER A 83 -1.314 -9.817 -1.100 1.00 0.00 C ATOM 1318 OG SER A 83 -2.365 -9.941 -2.054 1.00 0.00 O ATOM 0 H SER A 83 -1.588 -12.553 -2.066 1.00 0.00 H new ATOM 0 HA SER A 83 -0.111 -11.153 0.103 1.00 0.00 H new ATOM 0 HB2 SER A 83 -1.608 -9.136 -0.302 1.00 0.00 H new ATOM 0 HB3 SER A 83 -0.427 -9.393 -1.570 1.00 0.00 H new ATOM 0 HG SER A 83 -3.121 -9.380 -1.782 1.00 0.00 H new ATOM 1324 N LEU A 84 -2.493 -10.938 1.353 1.00 0.00 N ATOM 1325 CA LEU A 84 -3.655 -11.328 2.210 1.00 0.00 C ATOM 1326 C LEU A 84 -3.996 -10.203 3.180 1.00 0.00 C ATOM 1327 O LEU A 84 -3.196 -9.826 4.010 1.00 0.00 O ATOM 1328 CB LEU A 84 -3.322 -12.601 2.984 1.00 0.00 C ATOM 1329 CG LEU A 84 -4.541 -13.521 2.979 1.00 0.00 C ATOM 1330 CD1 LEU A 84 -4.086 -14.967 3.147 1.00 0.00 C ATOM 1331 CD2 LEU A 84 -5.479 -13.139 4.122 1.00 0.00 C ATOM 0 H LEU A 84 -1.997 -10.098 1.649 1.00 0.00 H new ATOM 0 HA LEU A 84 -4.519 -11.513 1.571 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -2.469 -13.105 2.530 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -3.040 -12.356 4.008 1.00 0.00 H new ATOM 0 HG LEU A 84 -5.071 -13.416 2.032 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -4.955 -15.625 3.144 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -3.423 -15.238 2.325 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -3.554 -15.074 4.092 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -6.348 -13.797 4.115 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -4.955 -13.240 5.072 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -5.805 -12.107 3.995 1.00 0.00 H new ATOM 1343 N VAL A 85 -5.185 -9.665 3.068 1.00 0.00 N ATOM 1344 CA VAL A 85 -5.601 -8.544 3.961 1.00 0.00 C ATOM 1345 C VAL A 85 -6.280 -9.078 5.233 1.00 0.00 C ATOM 1346 O VAL A 85 -6.977 -10.072 5.219 1.00 0.00 O ATOM 1347 CB VAL A 85 -6.561 -7.624 3.182 1.00 0.00 C ATOM 1348 CG1 VAL A 85 -7.211 -6.587 4.114 1.00 0.00 C ATOM 1349 CG2 VAL A 85 -5.770 -6.890 2.097 1.00 0.00 C ATOM 0 H VAL A 85 -5.889 -9.958 2.391 1.00 0.00 H new ATOM 0 HA VAL A 85 -4.720 -7.982 4.271 1.00 0.00 H new ATOM 0 HB VAL A 85 -7.348 -8.235 2.740 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -7.883 -5.951 3.538 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -7.775 -7.101 4.893 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -6.436 -5.973 4.573 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -6.439 -6.235 1.539 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -4.983 -6.295 2.560 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -5.323 -7.616 1.418 1.00 0.00 H new ATOM 1359 N LYS A 86 -6.083 -8.381 6.324 1.00 0.00 N ATOM 1360 CA LYS A 86 -6.701 -8.769 7.618 1.00 0.00 C ATOM 1361 C LYS A 86 -6.942 -7.498 8.442 1.00 0.00 C ATOM 1362 O LYS A 86 -6.968 -6.403 7.915 1.00 0.00 O ATOM 1363 CB LYS A 86 -5.757 -9.712 8.369 1.00 0.00 C ATOM 1364 CG LYS A 86 -6.552 -10.847 9.026 1.00 0.00 C ATOM 1365 CD LYS A 86 -7.288 -11.670 7.959 1.00 0.00 C ATOM 1366 CE LYS A 86 -8.794 -11.373 8.009 1.00 0.00 C ATOM 1367 NZ LYS A 86 -9.527 -12.596 8.443 1.00 0.00 N ATOM 0 H LYS A 86 -5.506 -7.541 6.367 1.00 0.00 H new ATOM 0 HA LYS A 86 -7.648 -9.282 7.449 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -5.021 -10.126 7.680 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -5.206 -9.157 9.129 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -5.879 -11.491 9.592 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -7.269 -10.434 9.735 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -6.895 -11.432 6.970 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -7.113 -12.733 8.124 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -8.991 -10.553 8.700 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -9.146 -11.054 7.028 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -10.525 -12.521 8.161 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -9.103 -13.433 7.994 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -9.465 -12.689 9.477 1.00 0.00 H new ATOM 1381 N TRP A 87 -7.136 -7.645 9.721 1.00 0.00 N ATOM 1382 CA TRP A 87 -7.395 -6.463 10.598 1.00 0.00 C ATOM 1383 C TRP A 87 -6.384 -6.393 11.735 1.00 0.00 C ATOM 1384 O TRP A 87 -5.468 -7.186 11.839 1.00 0.00 O ATOM 1385 CB TRP A 87 -8.776 -6.599 11.206 1.00 0.00 C ATOM 1386 CG TRP A 87 -9.762 -6.572 10.117 1.00 0.00 C ATOM 1387 CD1 TRP A 87 -10.332 -7.657 9.580 1.00 0.00 C ATOM 1388 CD2 TRP A 87 -10.281 -5.424 9.402 1.00 0.00 C ATOM 1389 NE1 TRP A 87 -11.208 -7.252 8.604 1.00 0.00 N ATOM 1390 CE2 TRP A 87 -11.205 -5.883 8.447 1.00 0.00 C ATOM 1391 CE3 TRP A 87 -10.049 -4.041 9.496 1.00 0.00 C ATOM 1392 CZ2 TRP A 87 -11.880 -5.009 7.609 1.00 0.00 C ATOM 1393 CZ3 TRP A 87 -10.725 -3.152 8.648 1.00 0.00 C ATOM 1394 CH2 TRP A 87 -11.641 -3.638 7.706 1.00 0.00 C ATOM 0 H TRP A 87 -7.127 -8.543 10.205 1.00 0.00 H new ATOM 0 HA TRP A 87 -7.315 -5.561 9.992 1.00 0.00 H new ATOM 0 HB2 TRP A 87 -8.854 -7.530 11.767 1.00 0.00 H new ATOM 0 HB3 TRP A 87 -8.964 -5.787 11.909 1.00 0.00 H new ATOM 0 HD1 TRP A 87 -10.136 -8.680 9.866 1.00 0.00 H new ATOM 0 HE1 TRP A 87 -11.791 -7.888 8.060 1.00 0.00 H new ATOM 0 HE3 TRP A 87 -9.347 -3.662 10.224 1.00 0.00 H new ATOM 0 HZ2 TRP A 87 -12.587 -5.387 6.885 1.00 0.00 H new ATOM 0 HZ3 TRP A 87 -10.539 -2.091 8.721 1.00 0.00 H new ATOM 0 HH2 TRP A 87 -12.162 -2.951 7.055 1.00 0.00 H new ATOM 1405 N GLU A 88 -6.576 -5.436 12.592 1.00 0.00 N ATOM 1406 CA GLU A 88 -5.683 -5.248 13.763 1.00 0.00 C ATOM 1407 C GLU A 88 -6.577 -4.902 14.960 1.00 0.00 C ATOM 1408 O GLU A 88 -6.573 -5.570 15.976 1.00 0.00 O ATOM 1409 CB GLU A 88 -4.697 -4.105 13.427 1.00 0.00 C ATOM 1410 CG GLU A 88 -4.239 -3.332 14.677 1.00 0.00 C ATOM 1411 CD GLU A 88 -3.504 -4.279 15.627 1.00 0.00 C ATOM 1412 OE1 GLU A 88 -4.161 -4.870 16.468 1.00 0.00 O ATOM 1413 OE2 GLU A 88 -2.297 -4.395 15.499 1.00 0.00 O ATOM 0 H GLU A 88 -7.335 -4.758 12.528 1.00 0.00 H new ATOM 0 HA GLU A 88 -5.102 -6.139 14.003 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -3.825 -4.519 12.921 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -5.171 -3.414 12.730 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -3.584 -2.510 14.389 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -5.100 -2.892 15.180 1.00 0.00 H new ATOM 1420 N SER A 89 -7.338 -3.856 14.822 1.00 0.00 N ATOM 1421 CA SER A 89 -8.249 -3.423 15.914 1.00 0.00 C ATOM 1422 C SER A 89 -9.690 -3.438 15.404 1.00 0.00 C ATOM 1423 O SER A 89 -10.574 -4.014 16.004 1.00 0.00 O ATOM 1424 CB SER A 89 -7.882 -1.998 16.327 1.00 0.00 C ATOM 1425 OG SER A 89 -7.777 -1.188 15.158 1.00 0.00 O ATOM 0 H SER A 89 -7.368 -3.273 13.985 1.00 0.00 H new ATOM 0 HA SER A 89 -8.153 -4.097 16.766 1.00 0.00 H new ATOM 0 HB2 SER A 89 -8.640 -1.594 16.998 1.00 0.00 H new ATOM 0 HB3 SER A 89 -6.938 -1.995 16.873 1.00 0.00 H new ATOM 0 HG SER A 89 -7.543 -0.272 15.415 1.00 0.00 H new ATOM 1431 N GLU A 90 -9.910 -2.793 14.294 1.00 0.00 N ATOM 1432 CA GLU A 90 -11.270 -2.710 13.672 1.00 0.00 C ATOM 1433 C GLU A 90 -11.200 -1.664 12.563 1.00 0.00 C ATOM 1434 O GLU A 90 -11.786 -1.808 11.509 1.00 0.00 O ATOM 1435 CB GLU A 90 -12.326 -2.280 14.703 1.00 0.00 C ATOM 1436 CG GLU A 90 -11.866 -1.006 15.418 1.00 0.00 C ATOM 1437 CD GLU A 90 -12.350 -1.031 16.869 1.00 0.00 C ATOM 1438 OE1 GLU A 90 -13.446 -0.555 17.115 1.00 0.00 O ATOM 1439 OE2 GLU A 90 -11.617 -1.526 17.709 1.00 0.00 O ATOM 0 H GLU A 90 -9.183 -2.303 13.772 1.00 0.00 H new ATOM 0 HA GLU A 90 -11.557 -3.688 13.286 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -13.281 -2.105 14.207 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -12.485 -3.078 15.429 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -10.779 -0.932 15.387 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -12.260 -0.127 14.907 1.00 0.00 H new ATOM 1446 N ASN A 91 -10.439 -0.631 12.794 1.00 0.00 N ATOM 1447 CA ASN A 91 -10.248 0.434 11.770 1.00 0.00 C ATOM 1448 C ASN A 91 -8.807 0.372 11.261 1.00 0.00 C ATOM 1449 O ASN A 91 -8.406 1.171 10.437 1.00 0.00 O ATOM 1450 CB ASN A 91 -10.498 1.803 12.389 1.00 0.00 C ATOM 1451 CG ASN A 91 -11.924 1.889 12.938 1.00 0.00 C ATOM 1452 OD1 ASN A 91 -12.638 0.906 12.988 1.00 0.00 O ATOM 1453 ND2 ASN A 91 -12.373 3.044 13.347 1.00 0.00 N ATOM 0 H ASN A 91 -9.932 -0.477 13.666 1.00 0.00 H new ATOM 0 HA ASN A 91 -10.949 0.279 10.949 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -9.782 1.983 13.191 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -10.342 2.581 11.642 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -13.323 3.123 13.709 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -11.774 3.868 13.305 1.00 0.00 H new ATOM 1460 N LYS A 92 -8.024 -0.577 11.735 1.00 0.00 N ATOM 1461 CA LYS A 92 -6.637 -0.706 11.258 1.00 0.00 C ATOM 1462 C LYS A 92 -6.520 -2.093 10.632 1.00 0.00 C ATOM 1463 O LYS A 92 -6.794 -3.087 11.269 1.00 0.00 O ATOM 1464 CB LYS A 92 -5.672 -0.571 12.435 1.00 0.00 C ATOM 1465 CG LYS A 92 -4.309 -0.122 11.918 1.00 0.00 C ATOM 1466 CD LYS A 92 -3.468 -1.345 11.549 1.00 0.00 C ATOM 1467 CE LYS A 92 -1.984 -1.023 11.740 1.00 0.00 C ATOM 1468 NZ LYS A 92 -1.543 -0.065 10.687 1.00 0.00 N ATOM 0 H LYS A 92 -8.305 -1.263 12.436 1.00 0.00 H new ATOM 0 HA LYS A 92 -6.389 0.070 10.534 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -6.057 0.151 13.155 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -5.580 -1.524 12.957 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -4.434 0.521 11.047 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -3.797 0.467 12.679 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -3.750 -2.194 12.172 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -3.658 -1.631 10.515 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -1.818 -0.595 12.729 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -1.393 -1.937 11.685 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -0.854 -0.530 10.061 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -2.366 0.241 10.130 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -1.100 0.763 11.134 1.00 0.00 H new ATOM 1482 N MET A 93 -6.141 -2.167 9.390 1.00 0.00 N ATOM 1483 CA MET A 93 -6.028 -3.486 8.715 1.00 0.00 C ATOM 1484 C MET A 93 -4.655 -3.627 8.092 1.00 0.00 C ATOM 1485 O MET A 93 -3.940 -2.665 7.887 1.00 0.00 O ATOM 1486 CB MET A 93 -7.097 -3.681 7.617 1.00 0.00 C ATOM 1487 CG MET A 93 -7.621 -2.343 7.072 1.00 0.00 C ATOM 1488 SD MET A 93 -7.960 -2.491 5.298 1.00 0.00 S ATOM 1489 CE MET A 93 -9.038 -3.940 5.397 1.00 0.00 C ATOM 0 H MET A 93 -5.903 -1.364 8.809 1.00 0.00 H new ATOM 0 HA MET A 93 -6.186 -4.249 9.477 1.00 0.00 H new ATOM 0 HB2 MET A 93 -6.673 -4.263 6.799 1.00 0.00 H new ATOM 0 HB3 MET A 93 -7.929 -4.258 8.021 1.00 0.00 H new ATOM 0 HG2 MET A 93 -8.529 -2.055 7.602 1.00 0.00 H new ATOM 0 HG3 MET A 93 -6.887 -1.557 7.247 1.00 0.00 H new ATOM 0 HE1 MET A 93 -9.415 -4.182 4.403 1.00 0.00 H new ATOM 0 HE2 MET A 93 -8.474 -4.787 5.787 1.00 0.00 H new ATOM 0 HE3 MET A 93 -9.876 -3.726 6.061 1.00 0.00 H new ATOM 1499 N VAL A 94 -4.291 -4.835 7.806 1.00 0.00 N ATOM 1500 CA VAL A 94 -2.961 -5.107 7.203 1.00 0.00 C ATOM 1501 C VAL A 94 -3.134 -5.827 5.876 1.00 0.00 C ATOM 1502 O VAL A 94 -4.230 -6.056 5.406 1.00 0.00 O ATOM 1503 CB VAL A 94 -2.156 -6.012 8.139 1.00 0.00 C ATOM 1504 CG1 VAL A 94 -1.642 -5.204 9.325 1.00 0.00 C ATOM 1505 CG2 VAL A 94 -3.057 -7.138 8.639 1.00 0.00 C ATOM 0 H VAL A 94 -4.866 -5.663 7.966 1.00 0.00 H new ATOM 0 HA VAL A 94 -2.442 -4.161 7.048 1.00 0.00 H new ATOM 0 HB VAL A 94 -1.306 -6.430 7.600 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -1.070 -5.854 9.987 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -1.002 -4.398 8.966 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -2.486 -4.782 9.871 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -2.491 -7.788 9.307 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -3.904 -6.714 9.178 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -3.420 -7.718 7.790 1.00 0.00 H new ATOM 1515 N CYS A 95 -2.042 -6.197 5.291 1.00 0.00 N ATOM 1516 CA CYS A 95 -2.070 -6.936 4.007 1.00 0.00 C ATOM 1517 C CYS A 95 -0.696 -7.544 3.816 1.00 0.00 C ATOM 1518 O CYS A 95 0.116 -7.040 3.070 1.00 0.00 O ATOM 1519 CB CYS A 95 -2.389 -5.992 2.860 1.00 0.00 C ATOM 1520 SG CYS A 95 -2.634 -6.953 1.345 1.00 0.00 S ATOM 0 H CYS A 95 -1.107 -6.015 5.656 1.00 0.00 H new ATOM 0 HA CYS A 95 -2.839 -7.708 4.023 1.00 0.00 H new ATOM 0 HB2 CYS A 95 -3.285 -5.415 3.087 1.00 0.00 H new ATOM 0 HB3 CYS A 95 -1.576 -5.278 2.724 1.00 0.00 H new ATOM 0 HG CYS A 95 -2.638 -6.154 0.320 1.00 0.00 H new ATOM 1526 N GLU A 96 -0.420 -8.602 4.524 1.00 0.00 N ATOM 1527 CA GLU A 96 0.927 -9.222 4.431 1.00 0.00 C ATOM 1528 C GLU A 96 1.149 -9.841 3.054 1.00 0.00 C ATOM 1529 O GLU A 96 0.571 -10.856 2.713 1.00 0.00 O ATOM 1530 CB GLU A 96 1.086 -10.301 5.498 1.00 0.00 C ATOM 1531 CG GLU A 96 2.548 -10.749 5.526 1.00 0.00 C ATOM 1532 CD GLU A 96 2.696 -11.966 6.441 1.00 0.00 C ATOM 1533 OE1 GLU A 96 1.901 -12.882 6.310 1.00 0.00 O ATOM 1534 OE2 GLU A 96 3.603 -11.961 7.258 1.00 0.00 O ATOM 0 H GLU A 96 -1.069 -9.063 5.162 1.00 0.00 H new ATOM 0 HA GLU A 96 1.668 -8.438 4.589 1.00 0.00 H new ATOM 0 HB2 GLU A 96 0.790 -9.915 6.473 1.00 0.00 H new ATOM 0 HB3 GLU A 96 0.435 -11.148 5.280 1.00 0.00 H new ATOM 0 HG2 GLU A 96 2.882 -10.997 4.518 1.00 0.00 H new ATOM 0 HG3 GLU A 96 3.181 -9.936 5.881 1.00 0.00 H new ATOM 1541 N GLN A 97 2.008 -9.241 2.275 1.00 0.00 N ATOM 1542 CA GLN A 97 2.316 -9.779 0.932 1.00 0.00 C ATOM 1543 C GLN A 97 3.619 -10.580 1.021 1.00 0.00 C ATOM 1544 O GLN A 97 4.626 -10.077 1.483 1.00 0.00 O ATOM 1545 CB GLN A 97 2.493 -8.612 -0.036 1.00 0.00 C ATOM 1546 CG GLN A 97 1.203 -7.793 -0.096 1.00 0.00 C ATOM 1547 CD GLN A 97 0.995 -7.263 -1.517 1.00 0.00 C ATOM 1548 OE1 GLN A 97 1.938 -7.126 -2.272 1.00 0.00 O ATOM 1549 NE2 GLN A 97 -0.209 -6.955 -1.915 1.00 0.00 N ATOM 0 H GLN A 97 2.513 -8.390 2.521 1.00 0.00 H new ATOM 0 HA GLN A 97 1.510 -10.423 0.579 1.00 0.00 H new ATOM 0 HB2 GLN A 97 3.321 -7.981 0.287 1.00 0.00 H new ATOM 0 HB3 GLN A 97 2.745 -8.985 -1.029 1.00 0.00 H new ATOM 0 HG2 GLN A 97 0.355 -8.410 0.200 1.00 0.00 H new ATOM 0 HG3 GLN A 97 1.255 -6.963 0.608 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -1.000 -7.070 -1.282 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -0.359 -6.599 -2.859 1.00 0.00 H new ATOM 1558 N LYS A 98 3.614 -11.823 0.603 1.00 0.00 N ATOM 1559 CA LYS A 98 4.869 -12.637 0.692 1.00 0.00 C ATOM 1560 C LYS A 98 5.177 -13.294 -0.655 1.00 0.00 C ATOM 1561 O LYS A 98 4.321 -13.402 -1.510 1.00 0.00 O ATOM 1562 CB LYS A 98 4.703 -13.719 1.767 1.00 0.00 C ATOM 1563 CG LYS A 98 3.514 -14.627 1.424 1.00 0.00 C ATOM 1564 CD LYS A 98 2.694 -14.906 2.686 1.00 0.00 C ATOM 1565 CE LYS A 98 1.546 -15.860 2.350 1.00 0.00 C ATOM 1566 NZ LYS A 98 0.452 -15.692 3.347 1.00 0.00 N ATOM 0 H LYS A 98 2.806 -12.305 0.209 1.00 0.00 H new ATOM 0 HA LYS A 98 5.697 -11.979 0.958 1.00 0.00 H new ATOM 0 HB2 LYS A 98 5.614 -14.313 1.840 1.00 0.00 H new ATOM 0 HB3 LYS A 98 4.546 -13.254 2.740 1.00 0.00 H new ATOM 0 HG2 LYS A 98 2.887 -14.151 0.670 1.00 0.00 H new ATOM 0 HG3 LYS A 98 3.871 -15.564 0.997 1.00 0.00 H new ATOM 0 HD2 LYS A 98 3.330 -15.343 3.456 1.00 0.00 H new ATOM 0 HD3 LYS A 98 2.299 -13.973 3.089 1.00 0.00 H new ATOM 0 HE2 LYS A 98 1.172 -15.657 1.346 1.00 0.00 H new ATOM 0 HE3 LYS A 98 1.902 -16.890 2.355 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -0.328 -16.340 3.119 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 0.813 -15.907 4.298 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 0.106 -14.712 3.321 1.00 0.00 H new ATOM 1580 N LEU A 99 6.394 -13.751 -0.838 1.00 0.00 N ATOM 1581 CA LEU A 99 6.752 -14.427 -2.129 1.00 0.00 C ATOM 1582 C LEU A 99 6.643 -15.946 -1.973 1.00 0.00 C ATOM 1583 O LEU A 99 7.219 -16.687 -2.742 1.00 0.00 O ATOM 1584 CB LEU A 99 8.165 -14.046 -2.622 1.00 0.00 C ATOM 1585 CG LEU A 99 9.118 -13.814 -1.451 1.00 0.00 C ATOM 1586 CD1 LEU A 99 10.534 -14.242 -1.846 1.00 0.00 C ATOM 1587 CD2 LEU A 99 9.122 -12.326 -1.091 1.00 0.00 C ATOM 0 H LEU A 99 7.150 -13.687 -0.156 1.00 0.00 H new ATOM 0 HA LEU A 99 6.043 -14.082 -2.882 1.00 0.00 H new ATOM 0 HB2 LEU A 99 8.556 -14.839 -3.260 1.00 0.00 H new ATOM 0 HB3 LEU A 99 8.109 -13.144 -3.232 1.00 0.00 H new ATOM 0 HG LEU A 99 8.788 -14.401 -0.594 1.00 0.00 H new ATOM 0 HD11 LEU A 99 11.211 -14.075 -1.009 1.00 0.00 H new ATOM 0 HD12 LEU A 99 10.535 -15.300 -2.108 1.00 0.00 H new ATOM 0 HD13 LEU A 99 10.866 -13.656 -2.703 1.00 0.00 H new ATOM 0 HD21 LEU A 99 9.801 -12.156 -0.255 1.00 0.00 H new ATOM 0 HD22 LEU A 99 9.452 -11.744 -1.952 1.00 0.00 H new ATOM 0 HD23 LEU A 99 8.115 -12.017 -0.809 1.00 0.00 H new ATOM 1599 N LEU A 100 5.874 -16.400 -0.996 1.00 0.00 N ATOM 1600 CA LEU A 100 5.653 -17.868 -0.747 1.00 0.00 C ATOM 1601 C LEU A 100 6.806 -18.462 0.073 1.00 0.00 C ATOM 1602 O LEU A 100 6.582 -19.108 1.080 1.00 0.00 O ATOM 1603 CB LEU A 100 5.477 -18.649 -2.061 1.00 0.00 C ATOM 1604 CG LEU A 100 4.439 -17.941 -2.945 1.00 0.00 C ATOM 1605 CD1 LEU A 100 4.883 -17.996 -4.405 1.00 0.00 C ATOM 1606 CD2 LEU A 100 3.082 -18.637 -2.804 1.00 0.00 C ATOM 0 H LEU A 100 5.378 -15.792 -0.344 1.00 0.00 H new ATOM 0 HA LEU A 100 4.730 -17.963 -0.176 1.00 0.00 H new ATOM 0 HB2 LEU A 100 6.430 -18.718 -2.585 1.00 0.00 H new ATOM 0 HB3 LEU A 100 5.155 -19.669 -1.850 1.00 0.00 H new ATOM 0 HG LEU A 100 4.351 -16.901 -2.630 1.00 0.00 H new ATOM 0 HD11 LEU A 100 4.144 -17.493 -5.029 1.00 0.00 H new ATOM 0 HD12 LEU A 100 5.847 -17.499 -4.511 1.00 0.00 H new ATOM 0 HD13 LEU A 100 4.975 -19.036 -4.718 1.00 0.00 H new ATOM 0 HD21 LEU A 100 2.348 -18.133 -3.432 1.00 0.00 H new ATOM 0 HD22 LEU A 100 3.173 -19.678 -3.116 1.00 0.00 H new ATOM 0 HD23 LEU A 100 2.759 -18.597 -1.764 1.00 0.00 H new ATOM 1618 N LYS A 101 8.027 -18.252 -0.340 1.00 0.00 N ATOM 1619 CA LYS A 101 9.186 -18.802 0.417 1.00 0.00 C ATOM 1620 C LYS A 101 9.897 -17.666 1.150 1.00 0.00 C ATOM 1621 O LYS A 101 10.254 -17.787 2.307 1.00 0.00 O ATOM 1622 CB LYS A 101 10.159 -19.474 -0.554 1.00 0.00 C ATOM 1623 CG LYS A 101 9.519 -20.744 -1.116 1.00 0.00 C ATOM 1624 CD LYS A 101 9.510 -21.830 -0.039 1.00 0.00 C ATOM 1625 CE LYS A 101 9.614 -23.206 -0.698 1.00 0.00 C ATOM 1626 NZ LYS A 101 8.856 -24.203 0.110 1.00 0.00 N ATOM 0 H LYS A 101 8.272 -17.719 -1.175 1.00 0.00 H new ATOM 0 HA LYS A 101 8.833 -19.537 1.140 1.00 0.00 H new ATOM 0 HB2 LYS A 101 10.411 -18.791 -1.365 1.00 0.00 H new ATOM 0 HB3 LYS A 101 11.090 -19.718 -0.043 1.00 0.00 H new ATOM 0 HG2 LYS A 101 8.501 -20.536 -1.446 1.00 0.00 H new ATOM 0 HG3 LYS A 101 10.073 -21.088 -1.989 1.00 0.00 H new ATOM 0 HD2 LYS A 101 10.342 -21.681 0.649 1.00 0.00 H new ATOM 0 HD3 LYS A 101 8.595 -21.765 0.549 1.00 0.00 H new ATOM 0 HE2 LYS A 101 9.216 -23.166 -1.712 1.00 0.00 H new ATOM 0 HE3 LYS A 101 10.659 -23.505 -0.777 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 8.927 -25.139 -0.338 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 9.255 -24.248 1.069 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 7.857 -23.919 0.163 1.00 0.00 H new ATOM 1640 N GLY A 102 10.098 -16.562 0.482 1.00 0.00 N ATOM 1641 CA GLY A 102 10.783 -15.403 1.125 1.00 0.00 C ATOM 1642 C GLY A 102 12.298 -15.592 1.052 1.00 0.00 C ATOM 1643 O GLY A 102 12.803 -16.691 1.186 1.00 0.00 O ATOM 0 H GLY A 102 9.816 -16.412 -0.487 1.00 0.00 H new ATOM 0 HA2 GLY A 102 10.498 -14.477 0.625 1.00 0.00 H new ATOM 0 HA3 GLY A 102 10.468 -15.314 2.165 1.00 0.00 H new ATOM 1647 N GLU A 103 13.022 -14.523 0.853 1.00 0.00 N ATOM 1648 CA GLU A 103 14.507 -14.617 0.783 1.00 0.00 C ATOM 1649 C GLU A 103 15.105 -13.784 1.916 1.00 0.00 C ATOM 1650 O GLU A 103 16.032 -14.199 2.586 1.00 0.00 O ATOM 1651 CB GLU A 103 15.004 -14.097 -0.571 1.00 0.00 C ATOM 1652 CG GLU A 103 14.449 -12.693 -0.833 1.00 0.00 C ATOM 1653 CD GLU A 103 14.884 -12.225 -2.223 1.00 0.00 C ATOM 1654 OE1 GLU A 103 14.654 -12.957 -3.172 1.00 0.00 O ATOM 1655 OE2 GLU A 103 15.440 -11.143 -2.316 1.00 0.00 O ATOM 0 H GLU A 103 12.644 -13.583 0.735 1.00 0.00 H new ATOM 0 HA GLU A 103 14.816 -15.657 0.887 1.00 0.00 H new ATOM 0 HB2 GLU A 103 16.094 -14.073 -0.582 1.00 0.00 H new ATOM 0 HB3 GLU A 103 14.692 -14.774 -1.366 1.00 0.00 H new ATOM 0 HG2 GLU A 103 13.361 -12.701 -0.764 1.00 0.00 H new ATOM 0 HG3 GLU A 103 14.811 -12.000 -0.074 1.00 0.00 H new ATOM 1662 N GLY A 104 14.563 -12.618 2.140 1.00 0.00 N ATOM 1663 CA GLY A 104 15.062 -11.743 3.233 1.00 0.00 C ATOM 1664 C GLY A 104 13.887 -10.901 3.756 1.00 0.00 C ATOM 1665 O GLY A 104 13.217 -11.312 4.683 1.00 0.00 O ATOM 0 H GLY A 104 13.786 -12.232 1.604 1.00 0.00 H new ATOM 0 HA2 GLY A 104 15.485 -12.345 4.037 1.00 0.00 H new ATOM 0 HA3 GLY A 104 15.859 -11.096 2.867 1.00 0.00 H new ATOM 1669 N PRO A 105 13.649 -9.751 3.150 1.00 0.00 N ATOM 1670 CA PRO A 105 12.541 -8.875 3.558 1.00 0.00 C ATOM 1671 C PRO A 105 11.228 -9.351 2.920 1.00 0.00 C ATOM 1672 O PRO A 105 11.113 -10.492 2.512 1.00 0.00 O ATOM 1673 CB PRO A 105 12.955 -7.502 3.030 1.00 0.00 C ATOM 1674 CG PRO A 105 13.962 -7.750 1.881 1.00 0.00 C ATOM 1675 CD PRO A 105 14.449 -9.207 2.024 1.00 0.00 C ATOM 0 HA PRO A 105 12.366 -8.867 4.634 1.00 0.00 H new ATOM 0 HB2 PRO A 105 12.088 -6.948 2.671 1.00 0.00 H new ATOM 0 HB3 PRO A 105 13.410 -6.905 3.820 1.00 0.00 H new ATOM 0 HG2 PRO A 105 13.489 -7.594 0.912 1.00 0.00 H new ATOM 0 HG3 PRO A 105 14.799 -7.054 1.943 1.00 0.00 H new ATOM 0 HD2 PRO A 105 14.283 -9.774 1.108 1.00 0.00 H new ATOM 0 HD3 PRO A 105 15.517 -9.251 2.237 1.00 0.00 H new ATOM 1683 N LYS A 106 10.233 -8.497 2.847 1.00 0.00 N ATOM 1684 CA LYS A 106 8.931 -8.913 2.257 1.00 0.00 C ATOM 1685 C LYS A 106 8.052 -7.686 2.006 1.00 0.00 C ATOM 1686 O LYS A 106 8.342 -6.597 2.464 1.00 0.00 O ATOM 1687 CB LYS A 106 8.237 -9.841 3.246 1.00 0.00 C ATOM 1688 CG LYS A 106 7.624 -11.031 2.505 1.00 0.00 C ATOM 1689 CD LYS A 106 7.699 -12.278 3.388 1.00 0.00 C ATOM 1690 CE LYS A 106 6.782 -12.101 4.599 1.00 0.00 C ATOM 1691 NZ LYS A 106 6.932 -13.270 5.511 1.00 0.00 N ATOM 0 H LYS A 106 10.272 -7.531 3.172 1.00 0.00 H new ATOM 0 HA LYS A 106 9.098 -9.422 1.308 1.00 0.00 H new ATOM 0 HB2 LYS A 106 8.952 -10.194 3.989 1.00 0.00 H new ATOM 0 HB3 LYS A 106 7.460 -9.297 3.784 1.00 0.00 H new ATOM 0 HG2 LYS A 106 6.587 -10.817 2.248 1.00 0.00 H new ATOM 0 HG3 LYS A 106 8.156 -11.203 1.569 1.00 0.00 H new ATOM 0 HD2 LYS A 106 7.401 -13.158 2.818 1.00 0.00 H new ATOM 0 HD3 LYS A 106 8.725 -12.443 3.716 1.00 0.00 H new ATOM 0 HE2 LYS A 106 7.032 -11.180 5.126 1.00 0.00 H new ATOM 0 HE3 LYS A 106 5.746 -12.011 4.274 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 6.309 -13.150 6.335 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 6.673 -14.141 5.005 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 7.919 -13.336 5.831 1.00 0.00 H new ATOM 1705 N THR A 107 6.972 -7.865 1.289 1.00 0.00 N ATOM 1706 CA THR A 107 6.058 -6.729 1.000 1.00 0.00 C ATOM 1707 C THR A 107 4.828 -6.829 1.899 1.00 0.00 C ATOM 1708 O THR A 107 4.592 -7.837 2.532 1.00 0.00 O ATOM 1709 CB THR A 107 5.625 -6.806 -0.470 1.00 0.00 C ATOM 1710 OG1 THR A 107 5.500 -8.166 -0.865 1.00 0.00 O ATOM 1711 CG2 THR A 107 6.664 -6.128 -1.356 1.00 0.00 C ATOM 0 H THR A 107 6.686 -8.759 0.890 1.00 0.00 H new ATOM 0 HA THR A 107 6.566 -5.783 1.188 1.00 0.00 H new ATOM 0 HB THR A 107 4.666 -6.300 -0.579 1.00 0.00 H new ATOM 0 HG1 THR A 107 5.222 -8.210 -1.804 1.00 0.00 H new ATOM 0 HG21 THR A 107 6.348 -6.187 -2.398 1.00 0.00 H new ATOM 0 HG22 THR A 107 6.763 -5.082 -1.066 1.00 0.00 H new ATOM 0 HG23 THR A 107 7.625 -6.629 -1.239 1.00 0.00 H new ATOM 1719 N SER A 108 4.046 -5.780 1.963 1.00 0.00 N ATOM 1720 CA SER A 108 2.817 -5.787 2.819 1.00 0.00 C ATOM 1721 C SER A 108 2.233 -4.374 2.852 1.00 0.00 C ATOM 1722 O SER A 108 2.845 -3.439 2.375 1.00 0.00 O ATOM 1723 CB SER A 108 3.175 -6.203 4.251 1.00 0.00 C ATOM 1724 OG SER A 108 4.419 -5.619 4.613 1.00 0.00 O ATOM 0 H SER A 108 4.207 -4.911 1.454 1.00 0.00 H new ATOM 0 HA SER A 108 2.096 -6.493 2.407 1.00 0.00 H new ATOM 0 HB2 SER A 108 2.395 -5.882 4.941 1.00 0.00 H new ATOM 0 HB3 SER A 108 3.236 -7.289 4.322 1.00 0.00 H new ATOM 0 HG SER A 108 4.650 -5.882 5.528 1.00 0.00 H new ATOM 1730 N TRP A 109 1.080 -4.201 3.450 1.00 0.00 N ATOM 1731 CA TRP A 109 0.498 -2.828 3.562 1.00 0.00 C ATOM 1732 C TRP A 109 -0.568 -2.806 4.627 1.00 0.00 C ATOM 1733 O TRP A 109 -1.313 -3.752 4.801 1.00 0.00 O ATOM 1734 CB TRP A 109 -0.057 -2.285 2.225 1.00 0.00 C ATOM 1735 CG TRP A 109 -1.271 -2.988 1.695 1.00 0.00 C ATOM 1736 CD1 TRP A 109 -1.289 -3.658 0.524 1.00 0.00 C ATOM 1737 CD2 TRP A 109 -2.647 -3.036 2.216 1.00 0.00 C ATOM 1738 NE1 TRP A 109 -2.568 -4.125 0.286 1.00 0.00 N ATOM 1739 CE2 TRP A 109 -3.440 -3.776 1.297 1.00 0.00 C ATOM 1740 CE3 TRP A 109 -3.286 -2.535 3.379 1.00 0.00 C ATOM 1741 CZ2 TRP A 109 -4.801 -4.002 1.519 1.00 0.00 C ATOM 1742 CZ3 TRP A 109 -4.651 -2.770 3.595 1.00 0.00 C ATOM 1743 CH2 TRP A 109 -5.403 -3.499 2.670 1.00 0.00 C ATOM 0 H TRP A 109 0.520 -4.946 3.863 1.00 0.00 H new ATOM 0 HA TRP A 109 1.314 -2.162 3.843 1.00 0.00 H new ATOM 0 HB2 TRP A 109 -0.297 -1.230 2.354 1.00 0.00 H new ATOM 0 HB3 TRP A 109 0.731 -2.343 1.474 1.00 0.00 H new ATOM 0 HD1 TRP A 109 -0.438 -3.806 -0.125 1.00 0.00 H new ATOM 0 HE1 TRP A 109 -2.835 -4.663 -0.538 1.00 0.00 H new ATOM 0 HE3 TRP A 109 -2.718 -1.969 4.102 1.00 0.00 H new ATOM 0 HZ2 TRP A 109 -5.383 -4.563 0.803 1.00 0.00 H new ATOM 0 HZ3 TRP A 109 -5.126 -2.384 4.485 1.00 0.00 H new ATOM 0 HH2 TRP A 109 -6.454 -3.673 2.848 1.00 0.00 H new ATOM 1754 N THR A 110 -0.638 -1.722 5.355 1.00 0.00 N ATOM 1755 CA THR A 110 -1.658 -1.619 6.430 1.00 0.00 C ATOM 1756 C THR A 110 -2.409 -0.300 6.316 1.00 0.00 C ATOM 1757 O THR A 110 -1.876 0.763 6.556 1.00 0.00 O ATOM 1758 CB THR A 110 -0.996 -1.713 7.799 1.00 0.00 C ATOM 1759 OG1 THR A 110 -0.296 -0.507 8.073 1.00 0.00 O ATOM 1760 CG2 THR A 110 -0.024 -2.892 7.828 1.00 0.00 C ATOM 0 H THR A 110 -0.033 -0.908 5.249 1.00 0.00 H new ATOM 0 HA THR A 110 -2.362 -2.444 6.318 1.00 0.00 H new ATOM 0 HB THR A 110 -1.763 -1.866 8.558 1.00 0.00 H new ATOM 0 HG1 THR A 110 -0.844 0.258 7.800 1.00 0.00 H new ATOM 0 HG21 THR A 110 0.445 -2.953 8.810 1.00 0.00 H new ATOM 0 HG22 THR A 110 -0.567 -3.816 7.627 1.00 0.00 H new ATOM 0 HG23 THR A 110 0.744 -2.750 7.067 1.00 0.00 H new ATOM 1768 N ARG A 111 -3.658 -0.383 5.974 1.00 0.00 N ATOM 1769 CA ARG A 111 -4.504 0.842 5.848 1.00 0.00 C ATOM 1770 C ARG A 111 -5.092 1.153 7.218 1.00 0.00 C ATOM 1771 O ARG A 111 -5.689 0.302 7.825 1.00 0.00 O ATOM 1772 CB ARG A 111 -5.632 0.570 4.844 1.00 0.00 C ATOM 1773 CG ARG A 111 -5.076 0.605 3.420 1.00 0.00 C ATOM 1774 CD ARG A 111 -6.163 0.166 2.438 1.00 0.00 C ATOM 1775 NE ARG A 111 -5.896 0.763 1.099 1.00 0.00 N ATOM 1776 CZ ARG A 111 -4.834 0.412 0.424 1.00 0.00 C ATOM 1777 NH1 ARG A 111 -4.470 -0.841 0.381 1.00 0.00 N ATOM 1778 NH2 ARG A 111 -4.137 1.315 -0.209 1.00 0.00 N ATOM 0 H ARG A 111 -4.142 -1.258 5.772 1.00 0.00 H new ATOM 0 HA ARG A 111 -3.912 1.687 5.497 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -6.083 -0.402 5.044 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -6.419 1.316 4.956 1.00 0.00 H new ATOM 0 HG2 ARG A 111 -4.735 1.611 3.176 1.00 0.00 H new ATOM 0 HG3 ARG A 111 -4.211 -0.053 3.340 1.00 0.00 H new ATOM 0 HD2 ARG A 111 -6.184 -0.921 2.365 1.00 0.00 H new ATOM 0 HD3 ARG A 111 -7.142 0.480 2.799 1.00 0.00 H new ATOM 0 HE ARG A 111 -6.544 1.447 0.709 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -5.015 -1.548 0.875 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -3.641 -1.113 -0.147 1.00 0.00 H new ATOM 0 HH21 ARG A 111 -4.421 2.294 -0.177 1.00 0.00 H new ATOM 0 HH22 ARG A 111 -3.308 1.042 -0.736 1.00 0.00 H new ATOM 1792 N GLU A 112 -4.931 2.351 7.721 1.00 0.00 N ATOM 1793 CA GLU A 112 -5.493 2.658 9.071 1.00 0.00 C ATOM 1794 C GLU A 112 -6.322 3.933 9.019 1.00 0.00 C ATOM 1795 O GLU A 112 -6.088 4.805 8.213 1.00 0.00 O ATOM 1796 CB GLU A 112 -4.357 2.821 10.082 1.00 0.00 C ATOM 1797 CG GLU A 112 -4.942 2.917 11.493 1.00 0.00 C ATOM 1798 CD GLU A 112 -3.806 3.020 12.513 1.00 0.00 C ATOM 1799 OE1 GLU A 112 -2.799 3.629 12.190 1.00 0.00 O ATOM 1800 OE2 GLU A 112 -3.962 2.489 13.600 1.00 0.00 O ATOM 0 H GLU A 112 -4.442 3.120 7.263 1.00 0.00 H new ATOM 0 HA GLU A 112 -6.134 1.833 9.380 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -3.673 1.975 10.017 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -3.779 3.716 9.855 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -5.593 3.788 11.569 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -5.555 2.041 11.704 1.00 0.00 H new ATOM 1807 N LEU A 113 -7.301 4.026 9.873 1.00 0.00 N ATOM 1808 CA LEU A 113 -8.187 5.219 9.903 1.00 0.00 C ATOM 1809 C LEU A 113 -7.886 6.038 11.161 1.00 0.00 C ATOM 1810 O LEU A 113 -7.212 5.574 12.062 1.00 0.00 O ATOM 1811 CB LEU A 113 -9.635 4.716 9.948 1.00 0.00 C ATOM 1812 CG LEU A 113 -10.176 4.365 8.552 1.00 0.00 C ATOM 1813 CD1 LEU A 113 -10.689 5.628 7.866 1.00 0.00 C ATOM 1814 CD2 LEU A 113 -9.113 3.693 7.685 1.00 0.00 C ATOM 0 H LEU A 113 -7.528 3.311 10.564 1.00 0.00 H new ATOM 0 HA LEU A 113 -8.027 5.847 9.027 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -9.692 3.836 10.589 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -10.268 5.480 10.399 1.00 0.00 H new ATOM 0 HG LEU A 113 -10.995 3.656 8.678 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -11.071 5.375 6.877 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -11.488 6.067 8.463 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -9.874 6.345 7.767 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -9.535 3.461 6.707 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -8.264 4.366 7.564 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -8.781 2.772 8.165 1.00 0.00 H new ATOM 1826 N THR A 114 -8.380 7.249 11.232 1.00 0.00 N ATOM 1827 CA THR A 114 -8.122 8.092 12.438 1.00 0.00 C ATOM 1828 C THR A 114 -9.187 9.187 12.546 1.00 0.00 C ATOM 1829 O THR A 114 -9.483 9.874 11.589 1.00 0.00 O ATOM 1830 CB THR A 114 -6.734 8.735 12.331 1.00 0.00 C ATOM 1831 OG1 THR A 114 -5.910 7.949 11.481 1.00 0.00 O ATOM 1832 CG2 THR A 114 -6.101 8.821 13.720 1.00 0.00 C ATOM 0 H THR A 114 -8.949 7.689 10.509 1.00 0.00 H new ATOM 0 HA THR A 114 -8.163 7.463 13.327 1.00 0.00 H new ATOM 0 HB THR A 114 -6.831 9.738 11.915 1.00 0.00 H new ATOM 0 HG1 THR A 114 -5.815 8.395 10.613 1.00 0.00 H new ATOM 0 HG21 THR A 114 -5.115 9.278 13.643 1.00 0.00 H new ATOM 0 HG22 THR A 114 -6.732 9.427 14.370 1.00 0.00 H new ATOM 0 HG23 THR A 114 -6.005 7.819 14.139 1.00 0.00 H new ATOM 1840 N ASN A 115 -9.758 9.348 13.713 1.00 0.00 N ATOM 1841 CA ASN A 115 -10.806 10.393 13.919 1.00 0.00 C ATOM 1842 C ASN A 115 -11.994 10.140 12.974 1.00 0.00 C ATOM 1843 O ASN A 115 -12.926 9.441 13.326 1.00 0.00 O ATOM 1844 CB ASN A 115 -10.201 11.782 13.677 1.00 0.00 C ATOM 1845 CG ASN A 115 -9.210 12.110 14.795 1.00 0.00 C ATOM 1846 OD1 ASN A 115 -9.369 11.664 15.914 1.00 0.00 O ATOM 1847 ND2 ASN A 115 -8.185 12.876 14.538 1.00 0.00 N ATOM 0 H ASN A 115 -9.540 8.793 14.541 1.00 0.00 H new ATOM 0 HA ASN A 115 -11.171 10.346 14.945 1.00 0.00 H new ATOM 0 HB2 ASN A 115 -9.697 11.807 12.711 1.00 0.00 H new ATOM 0 HB3 ASN A 115 -10.990 12.533 13.644 1.00 0.00 H new ATOM 0 HD21 ASN A 115 -7.518 13.100 15.276 1.00 0.00 H new ATOM 0 HD22 ASN A 115 -8.051 13.251 13.599 1.00 0.00 H new ATOM 1854 N ASP A 116 -11.975 10.698 11.786 1.00 0.00 N ATOM 1855 CA ASP A 116 -13.106 10.485 10.834 1.00 0.00 C ATOM 1856 C ASP A 116 -12.726 11.047 9.464 1.00 0.00 C ATOM 1857 O ASP A 116 -13.560 11.560 8.741 1.00 0.00 O ATOM 1858 CB ASP A 116 -14.349 11.208 11.351 1.00 0.00 C ATOM 1859 CG ASP A 116 -15.603 10.448 10.915 1.00 0.00 C ATOM 1860 OD1 ASP A 116 -15.598 9.232 11.013 1.00 0.00 O ATOM 1861 OD2 ASP A 116 -16.546 11.094 10.491 1.00 0.00 O ATOM 0 H ASP A 116 -11.223 11.292 11.437 1.00 0.00 H new ATOM 0 HA ASP A 116 -13.315 9.419 10.748 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -14.315 11.280 12.438 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -14.376 12.227 10.965 1.00 0.00 H new ATOM 1866 N GLY A 117 -11.472 10.954 9.107 1.00 0.00 N ATOM 1867 CA GLY A 117 -11.022 11.482 7.785 1.00 0.00 C ATOM 1868 C GLY A 117 -9.501 11.623 7.783 1.00 0.00 C ATOM 1869 O GLY A 117 -8.955 12.598 7.307 1.00 0.00 O ATOM 0 H GLY A 117 -10.737 10.534 9.676 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -11.336 10.810 6.987 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -11.488 12.448 7.590 1.00 0.00 H new ATOM 1873 N GLU A 118 -8.821 10.646 8.307 1.00 0.00 N ATOM 1874 CA GLU A 118 -7.333 10.685 8.340 1.00 0.00 C ATOM 1875 C GLU A 118 -6.828 9.258 8.127 1.00 0.00 C ATOM 1876 O GLU A 118 -6.356 8.604 9.037 1.00 0.00 O ATOM 1877 CB GLU A 118 -6.862 11.214 9.699 1.00 0.00 C ATOM 1878 CG GLU A 118 -6.845 12.749 9.684 1.00 0.00 C ATOM 1879 CD GLU A 118 -5.400 13.255 9.664 1.00 0.00 C ATOM 1880 OE1 GLU A 118 -4.563 12.576 9.095 1.00 0.00 O ATOM 1881 OE2 GLU A 118 -5.157 14.314 10.219 1.00 0.00 O ATOM 0 H GLU A 118 -9.237 9.811 8.719 1.00 0.00 H new ATOM 0 HA GLU A 118 -6.945 11.344 7.563 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -7.524 10.857 10.488 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -5.866 10.833 9.922 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -7.381 13.119 8.810 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -7.363 13.136 10.562 1.00 0.00 H new ATOM 1888 N LEU A 119 -6.972 8.767 6.928 1.00 0.00 N ATOM 1889 CA LEU A 119 -6.562 7.371 6.615 1.00 0.00 C ATOM 1890 C LEU A 119 -5.057 7.287 6.324 1.00 0.00 C ATOM 1891 O LEU A 119 -4.609 7.648 5.258 1.00 0.00 O ATOM 1892 CB LEU A 119 -7.348 6.920 5.382 1.00 0.00 C ATOM 1893 CG LEU A 119 -7.314 5.394 5.253 1.00 0.00 C ATOM 1894 CD1 LEU A 119 -8.699 4.873 4.851 1.00 0.00 C ATOM 1895 CD2 LEU A 119 -6.298 5.002 4.182 1.00 0.00 C ATOM 0 H LEU A 119 -7.363 9.283 6.140 1.00 0.00 H new ATOM 0 HA LEU A 119 -6.770 6.729 7.471 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -8.380 7.262 5.456 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -6.925 7.376 4.487 1.00 0.00 H new ATOM 0 HG LEU A 119 -7.030 4.958 6.211 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -8.667 3.787 4.761 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -9.428 5.153 5.612 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -8.988 5.308 3.894 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -6.270 3.917 4.087 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -6.587 5.443 3.228 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -5.311 5.367 4.466 1.00 0.00 H new ATOM 1907 N ILE A 120 -4.276 6.785 7.251 1.00 0.00 N ATOM 1908 CA ILE A 120 -2.806 6.653 6.997 1.00 0.00 C ATOM 1909 C ILE A 120 -2.545 5.256 6.432 1.00 0.00 C ATOM 1910 O ILE A 120 -2.705 4.263 7.106 1.00 0.00 O ATOM 1911 CB ILE A 120 -2.027 6.882 8.298 1.00 0.00 C ATOM 1912 CG1 ILE A 120 -2.386 5.811 9.333 1.00 0.00 C ATOM 1913 CG2 ILE A 120 -2.400 8.253 8.848 1.00 0.00 C ATOM 1914 CD1 ILE A 120 -1.289 4.745 9.368 1.00 0.00 C ATOM 0 H ILE A 120 -4.590 6.463 8.166 1.00 0.00 H new ATOM 0 HA ILE A 120 -2.471 7.401 6.279 1.00 0.00 H new ATOM 0 HB ILE A 120 -0.958 6.826 8.094 1.00 0.00 H new ATOM 0 HG12 ILE A 120 -2.498 6.265 10.318 1.00 0.00 H new ATOM 0 HG13 ILE A 120 -3.343 5.354 9.082 1.00 0.00 H new ATOM 0 HG21 ILE A 120 -1.855 8.434 9.775 1.00 0.00 H new ATOM 0 HG22 ILE A 120 -2.141 9.020 8.119 1.00 0.00 H new ATOM 0 HG23 ILE A 120 -3.472 8.287 9.045 1.00 0.00 H new ATOM 0 HD11 ILE A 120 -1.545 3.983 10.105 1.00 0.00 H new ATOM 0 HD12 ILE A 120 -1.199 4.283 8.385 1.00 0.00 H new ATOM 0 HD13 ILE A 120 -0.340 5.208 9.640 1.00 0.00 H new ATOM 1926 N LEU A 121 -2.191 5.180 5.181 1.00 0.00 N ATOM 1927 CA LEU A 121 -1.978 3.857 4.537 1.00 0.00 C ATOM 1928 C LEU A 121 -0.482 3.623 4.249 1.00 0.00 C ATOM 1929 O LEU A 121 0.166 4.377 3.547 1.00 0.00 O ATOM 1930 CB LEU A 121 -2.845 3.832 3.253 1.00 0.00 C ATOM 1931 CG LEU A 121 -2.515 2.659 2.311 1.00 0.00 C ATOM 1932 CD1 LEU A 121 -1.308 3.021 1.450 1.00 0.00 C ATOM 1933 CD2 LEU A 121 -2.212 1.384 3.094 1.00 0.00 C ATOM 0 H LEU A 121 -2.039 5.985 4.573 1.00 0.00 H new ATOM 0 HA LEU A 121 -2.280 3.042 5.195 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -3.896 3.776 3.535 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -2.709 4.770 2.714 1.00 0.00 H new ATOM 0 HG LEU A 121 -3.386 2.475 1.682 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -1.074 2.191 0.783 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -1.536 3.908 0.859 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -0.451 3.223 2.092 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -1.983 0.576 2.399 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -1.357 1.553 3.748 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -3.080 1.111 3.695 1.00 0.00 H new ATOM 1945 N THR A 122 0.051 2.563 4.809 1.00 0.00 N ATOM 1946 CA THR A 122 1.490 2.201 4.623 1.00 0.00 C ATOM 1947 C THR A 122 1.588 1.010 3.668 1.00 0.00 C ATOM 1948 O THR A 122 0.651 0.269 3.500 1.00 0.00 O ATOM 1949 CB THR A 122 2.058 1.771 5.970 1.00 0.00 C ATOM 1950 OG1 THR A 122 1.847 2.798 6.929 1.00 0.00 O ATOM 1951 CG2 THR A 122 3.553 1.484 5.839 1.00 0.00 C ATOM 0 H THR A 122 -0.468 1.917 5.404 1.00 0.00 H new ATOM 0 HA THR A 122 2.038 3.054 4.223 1.00 0.00 H new ATOM 0 HB THR A 122 1.550 0.864 6.297 1.00 0.00 H new ATOM 0 HG1 THR A 122 2.212 2.518 7.794 1.00 0.00 H new ATOM 0 HG21 THR A 122 3.951 1.177 6.806 1.00 0.00 H new ATOM 0 HG22 THR A 122 3.708 0.686 5.113 1.00 0.00 H new ATOM 0 HG23 THR A 122 4.068 2.384 5.504 1.00 0.00 H new ATOM 1959 N MET A 123 2.728 0.799 3.078 1.00 0.00 N ATOM 1960 CA MET A 123 2.896 -0.370 2.160 1.00 0.00 C ATOM 1961 C MET A 123 4.377 -0.711 2.062 1.00 0.00 C ATOM 1962 O MET A 123 5.116 -0.122 1.298 1.00 0.00 O ATOM 1963 CB MET A 123 2.336 -0.044 0.777 1.00 0.00 C ATOM 1964 CG MET A 123 2.341 -1.310 -0.089 1.00 0.00 C ATOM 1965 SD MET A 123 3.717 -1.255 -1.267 1.00 0.00 S ATOM 1966 CE MET A 123 3.813 -3.033 -1.587 1.00 0.00 C ATOM 0 H MET A 123 3.556 1.384 3.189 1.00 0.00 H new ATOM 0 HA MET A 123 2.348 -1.226 2.555 1.00 0.00 H new ATOM 0 HB2 MET A 123 1.321 0.344 0.866 1.00 0.00 H new ATOM 0 HB3 MET A 123 2.935 0.735 0.305 1.00 0.00 H new ATOM 0 HG2 MET A 123 2.430 -2.193 0.544 1.00 0.00 H new ATOM 0 HG3 MET A 123 1.396 -1.396 -0.626 1.00 0.00 H new ATOM 0 HE1 MET A 123 4.773 -3.269 -2.047 1.00 0.00 H new ATOM 0 HE2 MET A 123 3.717 -3.577 -0.648 1.00 0.00 H new ATOM 0 HE3 MET A 123 3.007 -3.326 -2.260 1.00 0.00 H new ATOM 1976 N THR A 124 4.812 -1.647 2.858 1.00 0.00 N ATOM 1977 CA THR A 124 6.257 -2.029 2.861 1.00 0.00 C ATOM 1978 C THR A 124 6.609 -2.804 1.603 1.00 0.00 C ATOM 1979 O THR A 124 5.752 -3.193 0.832 1.00 0.00 O ATOM 1980 CB THR A 124 6.622 -2.878 4.108 1.00 0.00 C ATOM 1981 OG1 THR A 124 6.537 -4.267 3.807 1.00 0.00 O ATOM 1982 CG2 THR A 124 5.697 -2.578 5.294 1.00 0.00 C ATOM 0 H THR A 124 4.228 -2.168 3.511 1.00 0.00 H new ATOM 0 HA THR A 124 6.834 -1.104 2.892 1.00 0.00 H new ATOM 0 HB THR A 124 7.643 -2.613 4.383 1.00 0.00 H new ATOM 0 HG1 THR A 124 5.760 -4.653 4.262 1.00 0.00 H new ATOM 0 HG21 THR A 124 5.987 -3.193 6.146 1.00 0.00 H new ATOM 0 HG22 THR A 124 5.779 -1.525 5.562 1.00 0.00 H new ATOM 0 HG23 THR A 124 4.667 -2.803 5.018 1.00 0.00 H new ATOM 1990 N ALA A 125 7.882 -3.031 1.403 1.00 0.00 N ATOM 1991 CA ALA A 125 8.316 -3.790 0.194 1.00 0.00 C ATOM 1992 C ALA A 125 9.821 -4.063 0.197 1.00 0.00 C ATOM 1993 O ALA A 125 10.622 -3.209 -0.118 1.00 0.00 O ATOM 1994 CB ALA A 125 7.959 -2.998 -1.059 1.00 0.00 C ATOM 0 H ALA A 125 8.634 -2.726 2.020 1.00 0.00 H new ATOM 0 HA ALA A 125 7.798 -4.749 0.205 1.00 0.00 H new ATOM 0 HB1 ALA A 125 8.276 -3.552 -1.942 1.00 0.00 H new ATOM 0 HB2 ALA A 125 6.881 -2.842 -1.096 1.00 0.00 H new ATOM 0 HB3 ALA A 125 8.465 -2.033 -1.036 1.00 0.00 H new ATOM 2000 N ASP A 126 10.216 -5.268 0.511 1.00 0.00 N ATOM 2001 CA ASP A 126 11.674 -5.604 0.509 1.00 0.00 C ATOM 2002 C ASP A 126 12.380 -4.798 1.602 1.00 0.00 C ATOM 2003 O ASP A 126 13.524 -4.415 1.457 1.00 0.00 O ATOM 2004 CB ASP A 126 12.285 -5.266 -0.858 1.00 0.00 C ATOM 2005 CG ASP A 126 12.933 -6.513 -1.467 1.00 0.00 C ATOM 2006 OD1 ASP A 126 12.244 -7.511 -1.596 1.00 0.00 O ATOM 2007 OD2 ASP A 126 14.107 -6.447 -1.792 1.00 0.00 O ATOM 0 H ASP A 126 9.595 -6.035 0.769 1.00 0.00 H new ATOM 0 HA ASP A 126 11.800 -6.669 0.701 1.00 0.00 H new ATOM 0 HB2 ASP A 126 11.513 -4.885 -1.526 1.00 0.00 H new ATOM 0 HB3 ASP A 126 13.029 -4.477 -0.748 1.00 0.00 H new ATOM 2012 N ASP A 127 11.681 -4.554 2.688 1.00 0.00 N ATOM 2013 CA ASP A 127 12.222 -3.784 3.868 1.00 0.00 C ATOM 2014 C ASP A 127 11.916 -2.291 3.732 1.00 0.00 C ATOM 2015 O ASP A 127 12.181 -1.525 4.641 1.00 0.00 O ATOM 2016 CB ASP A 127 13.737 -3.981 4.047 1.00 0.00 C ATOM 2017 CG ASP A 127 14.146 -3.553 5.457 1.00 0.00 C ATOM 2018 OD1 ASP A 127 14.059 -4.377 6.353 1.00 0.00 O ATOM 2019 OD2 ASP A 127 14.539 -2.410 5.617 1.00 0.00 O ATOM 0 H ASP A 127 10.719 -4.868 2.813 1.00 0.00 H new ATOM 0 HA ASP A 127 11.722 -4.180 4.752 1.00 0.00 H new ATOM 0 HB2 ASP A 127 14.000 -5.026 3.882 1.00 0.00 H new ATOM 0 HB3 ASP A 127 14.280 -3.395 3.306 1.00 0.00 H new ATOM 2024 N VAL A 128 11.348 -1.863 2.628 1.00 0.00 N ATOM 2025 CA VAL A 128 11.021 -0.427 2.479 1.00 0.00 C ATOM 2026 C VAL A 128 9.643 -0.180 3.084 1.00 0.00 C ATOM 2027 O VAL A 128 8.973 -1.099 3.509 1.00 0.00 O ATOM 2028 CB VAL A 128 11.022 -0.047 0.987 1.00 0.00 C ATOM 2029 CG1 VAL A 128 12.329 -0.506 0.335 1.00 0.00 C ATOM 2030 CG2 VAL A 128 9.845 -0.703 0.263 1.00 0.00 C ATOM 0 H VAL A 128 11.101 -2.451 1.832 1.00 0.00 H new ATOM 0 HA VAL A 128 11.763 0.184 2.992 1.00 0.00 H new ATOM 0 HB VAL A 128 10.929 1.036 0.909 1.00 0.00 H new ATOM 0 HG11 VAL A 128 12.324 -0.234 -0.721 1.00 0.00 H new ATOM 0 HG12 VAL A 128 13.172 -0.023 0.830 1.00 0.00 H new ATOM 0 HG13 VAL A 128 12.423 -1.588 0.431 1.00 0.00 H new ATOM 0 HG21 VAL A 128 9.863 -0.422 -0.790 1.00 0.00 H new ATOM 0 HG22 VAL A 128 9.922 -1.787 0.351 1.00 0.00 H new ATOM 0 HG23 VAL A 128 8.910 -0.368 0.712 1.00 0.00 H new ATOM 2040 N VAL A 129 9.220 1.045 3.110 1.00 0.00 N ATOM 2041 CA VAL A 129 7.881 1.354 3.661 1.00 0.00 C ATOM 2042 C VAL A 129 7.379 2.675 3.079 1.00 0.00 C ATOM 2043 O VAL A 129 7.967 3.721 3.259 1.00 0.00 O ATOM 2044 CB VAL A 129 7.962 1.353 5.202 1.00 0.00 C ATOM 2045 CG1 VAL A 129 7.053 2.425 5.841 1.00 0.00 C ATOM 2046 CG2 VAL A 129 7.527 -0.028 5.692 1.00 0.00 C ATOM 0 H VAL A 129 9.747 1.850 2.772 1.00 0.00 H new ATOM 0 HA VAL A 129 7.153 0.595 3.376 1.00 0.00 H new ATOM 0 HB VAL A 129 8.986 1.584 5.494 1.00 0.00 H new ATOM 0 HG11 VAL A 129 7.147 2.382 6.926 1.00 0.00 H new ATOM 0 HG12 VAL A 129 7.352 3.412 5.490 1.00 0.00 H new ATOM 0 HG13 VAL A 129 6.017 2.238 5.559 1.00 0.00 H new ATOM 0 HG21 VAL A 129 7.574 -0.059 6.781 1.00 0.00 H new ATOM 0 HG22 VAL A 129 6.505 -0.224 5.367 1.00 0.00 H new ATOM 0 HG23 VAL A 129 8.191 -0.787 5.278 1.00 0.00 H new ATOM 2056 N CYS A 130 6.274 2.605 2.394 1.00 0.00 N ATOM 2057 CA CYS A 130 5.673 3.828 1.788 1.00 0.00 C ATOM 2058 C CYS A 130 4.518 4.289 2.679 1.00 0.00 C ATOM 2059 O CYS A 130 3.407 3.805 2.565 1.00 0.00 O ATOM 2060 CB CYS A 130 5.141 3.500 0.391 1.00 0.00 C ATOM 2061 SG CYS A 130 5.087 5.012 -0.604 1.00 0.00 S ATOM 0 H CYS A 130 5.754 1.744 2.225 1.00 0.00 H new ATOM 0 HA CYS A 130 6.423 4.614 1.707 1.00 0.00 H new ATOM 0 HB2 CYS A 130 5.780 2.759 -0.089 1.00 0.00 H new ATOM 0 HB3 CYS A 130 4.145 3.063 0.463 1.00 0.00 H new ATOM 0 HG CYS A 130 4.637 4.734 -1.792 1.00 0.00 H new ATOM 2067 N THR A 131 4.778 5.203 3.578 1.00 0.00 N ATOM 2068 CA THR A 131 3.703 5.681 4.498 1.00 0.00 C ATOM 2069 C THR A 131 3.265 7.092 4.117 1.00 0.00 C ATOM 2070 O THR A 131 4.076 7.985 3.960 1.00 0.00 O ATOM 2071 CB THR A 131 4.236 5.702 5.932 1.00 0.00 C ATOM 2072 OG1 THR A 131 5.249 4.716 6.076 1.00 0.00 O ATOM 2073 CG2 THR A 131 3.096 5.413 6.913 1.00 0.00 C ATOM 0 H THR A 131 5.690 5.639 3.715 1.00 0.00 H new ATOM 0 HA THR A 131 2.851 5.006 4.420 1.00 0.00 H new ATOM 0 HB THR A 131 4.653 6.686 6.146 1.00 0.00 H new ATOM 0 HG1 THR A 131 5.592 4.731 6.994 1.00 0.00 H new ATOM 0 HG21 THR A 131 3.481 5.429 7.933 1.00 0.00 H new ATOM 0 HG22 THR A 131 2.322 6.173 6.805 1.00 0.00 H new ATOM 0 HG23 THR A 131 2.673 4.431 6.700 1.00 0.00 H new ATOM 2081 N ARG A 132 1.982 7.298 3.994 1.00 0.00 N ATOM 2082 CA ARG A 132 1.463 8.657 3.652 1.00 0.00 C ATOM 2083 C ARG A 132 0.053 8.798 4.215 1.00 0.00 C ATOM 2084 O ARG A 132 -0.770 7.912 4.082 1.00 0.00 O ATOM 2085 CB ARG A 132 1.448 8.885 2.131 1.00 0.00 C ATOM 2086 CG ARG A 132 1.127 7.590 1.383 1.00 0.00 C ATOM 2087 CD ARG A 132 0.840 7.914 -0.082 1.00 0.00 C ATOM 2088 NE ARG A 132 0.841 6.655 -0.879 1.00 0.00 N ATOM 2089 CZ ARG A 132 1.144 6.687 -2.148 1.00 0.00 C ATOM 2090 NH1 ARG A 132 0.482 7.468 -2.957 1.00 0.00 N ATOM 2091 NH2 ARG A 132 2.109 5.938 -2.607 1.00 0.00 N ATOM 0 H ARG A 132 1.266 6.581 4.116 1.00 0.00 H new ATOM 0 HA ARG A 132 2.122 9.407 4.090 1.00 0.00 H new ATOM 0 HB2 ARG A 132 0.708 9.646 1.882 1.00 0.00 H new ATOM 0 HB3 ARG A 132 2.417 9.265 1.808 1.00 0.00 H new ATOM 0 HG2 ARG A 132 1.964 6.896 1.457 1.00 0.00 H new ATOM 0 HG3 ARG A 132 0.265 7.099 1.835 1.00 0.00 H new ATOM 0 HD2 ARG A 132 -0.125 8.414 -0.173 1.00 0.00 H new ATOM 0 HD3 ARG A 132 1.593 8.602 -0.468 1.00 0.00 H new ATOM 0 HE ARG A 132 0.605 5.769 -0.433 1.00 0.00 H new ATOM 0 HH11 ARG A 132 -0.272 8.053 -2.598 1.00 0.00 H new ATOM 0 HH12 ARG A 132 0.719 7.493 -3.949 1.00 0.00 H new ATOM 0 HH21 ARG A 132 2.626 5.328 -1.974 1.00 0.00 H new ATOM 0 HH22 ARG A 132 2.346 5.963 -3.599 1.00 0.00 H new ATOM 2105 N VAL A 133 -0.223 9.902 4.856 1.00 0.00 N ATOM 2106 CA VAL A 133 -1.572 10.110 5.449 1.00 0.00 C ATOM 2107 C VAL A 133 -2.556 10.495 4.351 1.00 0.00 C ATOM 2108 O VAL A 133 -2.185 11.024 3.328 1.00 0.00 O ATOM 2109 CB VAL A 133 -1.486 11.225 6.506 1.00 0.00 C ATOM 2110 CG1 VAL A 133 -2.886 11.603 7.002 1.00 0.00 C ATOM 2111 CG2 VAL A 133 -0.644 10.736 7.687 1.00 0.00 C ATOM 0 H VAL A 133 0.432 10.671 4.994 1.00 0.00 H new ATOM 0 HA VAL A 133 -1.919 9.192 5.923 1.00 0.00 H new ATOM 0 HB VAL A 133 -1.024 12.104 6.056 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -2.806 12.393 7.749 1.00 0.00 H new ATOM 0 HG12 VAL A 133 -3.486 11.956 6.163 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -3.363 10.729 7.447 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -0.580 11.523 8.439 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -1.109 9.853 8.125 1.00 0.00 H new ATOM 0 HG23 VAL A 133 0.358 10.484 7.340 1.00 0.00 H new ATOM 2121 N TYR A 134 -3.812 10.241 4.578 1.00 0.00 N ATOM 2122 CA TYR A 134 -4.845 10.602 3.578 1.00 0.00 C ATOM 2123 C TYR A 134 -6.004 11.290 4.285 1.00 0.00 C ATOM 2124 O TYR A 134 -6.076 11.325 5.499 1.00 0.00 O ATOM 2125 CB TYR A 134 -5.424 9.360 2.925 1.00 0.00 C ATOM 2126 CG TYR A 134 -4.431 8.723 1.998 1.00 0.00 C ATOM 2127 CD1 TYR A 134 -3.344 8.022 2.518 1.00 0.00 C ATOM 2128 CD2 TYR A 134 -4.617 8.808 0.615 1.00 0.00 C ATOM 2129 CE1 TYR A 134 -2.440 7.405 1.659 1.00 0.00 C ATOM 2130 CE2 TYR A 134 -3.711 8.195 -0.248 1.00 0.00 C ATOM 2131 CZ TYR A 134 -2.619 7.490 0.272 1.00 0.00 C ATOM 2132 OH TYR A 134 -1.723 6.876 -0.579 1.00 0.00 O ATOM 0 H TYR A 134 -4.168 9.794 5.423 1.00 0.00 H new ATOM 0 HA TYR A 134 -4.376 11.243 2.832 1.00 0.00 H new ATOM 0 HB2 TYR A 134 -5.719 8.645 3.693 1.00 0.00 H new ATOM 0 HB3 TYR A 134 -6.326 9.623 2.372 1.00 0.00 H new ATOM 0 HD1 TYR A 134 -3.204 7.958 3.587 1.00 0.00 H new ATOM 0 HD2 TYR A 134 -5.462 9.349 0.216 1.00 0.00 H new ATOM 0 HE1 TYR A 134 -1.599 6.860 2.062 1.00 0.00 H new ATOM 0 HE2 TYR A 134 -3.851 8.264 -1.317 1.00 0.00 H new ATOM 0 HH TYR A 134 -1.994 7.032 -1.508 1.00 0.00 H new ATOM 2142 N VAL A 135 -6.938 11.779 3.526 1.00 0.00 N ATOM 2143 CA VAL A 135 -8.141 12.409 4.111 1.00 0.00 C ATOM 2144 C VAL A 135 -9.302 12.075 3.192 1.00 0.00 C ATOM 2145 O VAL A 135 -9.090 11.681 2.068 1.00 0.00 O ATOM 2146 CB VAL A 135 -7.966 13.907 4.200 1.00 0.00 C ATOM 2147 CG1 VAL A 135 -9.198 14.510 4.854 1.00 0.00 C ATOM 2148 CG2 VAL A 135 -6.738 14.209 5.047 1.00 0.00 C ATOM 0 H VAL A 135 -6.915 11.767 2.506 1.00 0.00 H new ATOM 0 HA VAL A 135 -8.317 12.039 5.121 1.00 0.00 H new ATOM 0 HB VAL A 135 -7.838 14.332 3.205 1.00 0.00 H new ATOM 0 HG11 VAL A 135 -9.081 15.592 4.923 1.00 0.00 H new ATOM 0 HG12 VAL A 135 -10.079 14.278 4.255 1.00 0.00 H new ATOM 0 HG13 VAL A 135 -9.319 14.094 5.854 1.00 0.00 H new ATOM 0 HG21 VAL A 135 -6.602 15.288 5.118 1.00 0.00 H new ATOM 0 HG22 VAL A 135 -6.874 13.794 6.046 1.00 0.00 H new ATOM 0 HG23 VAL A 135 -5.858 13.762 4.585 1.00 0.00 H new ATOM 2158 N ARG A 136 -10.516 12.205 3.636 1.00 0.00 N ATOM 2159 CA ARG A 136 -11.639 11.852 2.724 1.00 0.00 C ATOM 2160 C ARG A 136 -11.944 13.028 1.806 1.00 0.00 C ATOM 2161 O ARG A 136 -12.322 14.099 2.238 1.00 0.00 O ATOM 2162 CB ARG A 136 -12.896 11.449 3.496 1.00 0.00 C ATOM 2163 CG ARG A 136 -13.016 9.923 3.508 1.00 0.00 C ATOM 2164 CD ARG A 136 -13.588 9.462 4.849 1.00 0.00 C ATOM 2165 NE ARG A 136 -14.997 9.928 4.974 1.00 0.00 N ATOM 2166 CZ ARG A 136 -15.813 9.329 5.798 1.00 0.00 C ATOM 2167 NH1 ARG A 136 -16.276 8.144 5.509 1.00 0.00 N ATOM 2168 NH2 ARG A 136 -16.164 9.915 6.909 1.00 0.00 N ATOM 0 H ARG A 136 -10.779 12.531 4.566 1.00 0.00 H new ATOM 0 HA ARG A 136 -11.330 10.992 2.131 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -12.847 11.829 4.516 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -13.778 11.891 3.033 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -13.661 9.593 2.694 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -12.038 9.470 3.344 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -13.545 8.375 4.920 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -12.988 9.859 5.668 1.00 0.00 H new ATOM 0 HE ARG A 136 -15.325 10.716 4.415 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -16.000 7.687 4.640 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -16.914 7.675 6.152 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -15.801 10.841 7.134 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -16.802 9.447 7.553 1.00 0.00 H new ATOM 2182 N GLU A 137 -11.769 12.819 0.532 1.00 0.00 N ATOM 2183 CA GLU A 137 -12.027 13.893 -0.472 1.00 0.00 C ATOM 2184 C GLU A 137 -13.444 14.454 -0.302 1.00 0.00 C ATOM 2185 O GLU A 137 -14.236 13.814 0.371 1.00 0.00 O ATOM 2186 CB GLU A 137 -11.880 13.312 -1.880 1.00 0.00 C ATOM 2187 CG GLU A 137 -11.613 14.444 -2.873 1.00 0.00 C ATOM 2188 CD GLU A 137 -11.205 13.853 -4.224 1.00 0.00 C ATOM 2189 OE1 GLU A 137 -10.042 13.518 -4.374 1.00 0.00 O ATOM 2190 OE2 GLU A 137 -12.062 13.747 -5.085 1.00 0.00 O ATOM 2191 OXT GLU A 137 -13.711 15.512 -0.847 1.00 0.00 O ATOM 0 H GLU A 137 -11.453 11.934 0.135 1.00 0.00 H new ATOM 0 HA GLU A 137 -11.308 14.698 -0.322 1.00 0.00 H new ATOM 0 HB2 GLU A 137 -11.062 12.592 -1.904 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -12.786 12.775 -2.160 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -12.505 15.059 -2.988 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -10.824 15.094 -2.496 1.00 0.00 H new TER 2198 GLU A 137